data_2hp8_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 2hp8 _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 36.0 t0 . . . . . 0 N--CA 1.446 -0.647 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -55.91 -33.93 90.28 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 124.499 3.466 . . . . 0.0 113.068 -175.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 56.8 m -94.92 -13.2 25.61 Favored 'General case' 0 N--CA 1.435 -1.217 0 C-N-CA 125.815 1.646 . . . . 0.0 113.054 -169.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.6 tp60 -62.64 -25.94 68.37 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.695 0.68 . . . . 0.0 111.416 -177.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -61.21 -50.44 73.07 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.376 0.67 . . . . 0.0 110.195 172.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -64.47 -44.59 90.56 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 123.777 0.831 . . . . 0.0 109.149 179.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.59 -41.53 54.74 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 119.937 1.244 . . . . 0.0 113.035 174.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 84.6 m -56.56 -46.7 80.58 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 123.419 0.449 . . . . 0.0 110.128 174.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -60.28 -39.04 85.48 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 117.496 -1.24 . . . . 0.0 112.303 177.116 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 2.0 mp -59.16 -49.87 81.82 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 CA-C-N 120.451 1.478 . . . . 0.0 109.482 173.281 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 93.8 mm-40 -61.34 -51.35 69.18 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 -174.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 41.2 mtpt -68.89 -37.98 79.34 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 123.798 0.839 . . . . 0.0 111.945 -177.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 17.2 t -52.28 -46.45 65.87 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 169.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.57 -46.39 84.02 Favored 'General case' 0 N--CA 1.442 -0.856 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 -177.075 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -63.15 -44.2 96.2 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 118.999 0.818 . . . . 0.0 110.637 179.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -60.95 -14.11 20.49 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 113.193 0.812 . . . . 0.0 113.193 172.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 57.9 m-80 -122.34 11.51 10.04 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.59 1.556 . . . . 0.0 111.123 -177.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 12.6 m 51.6 43.31 29.86 Favored 'General case' 0 C--N 1.346 0.447 0 C-N-CA 125.026 1.33 . . . . 0.0 112.011 -179.256 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.271 7.4 m-85 73.49 14.26 4.38 Favored 'General case' 0 N--CA 1.441 -0.891 0 C-N-CA 129.14 2.976 . . . . 0.0 113.976 169.145 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 64.7 mtm -69.88 85.03 0.49 Allowed 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 125.37 1.468 . . . . 0.0 110.351 170.057 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -55.33 -17.6 5.04 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 127.115 2.166 . . . . 0.0 111.179 168.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 68.8 m -60.75 -54.06 49.86 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.76 1.624 . . . . 0.0 110.346 168.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 57.6 mttt -67.3 -43.29 82.07 Favored 'General case' 0 C--O 1.231 0.128 0 O-C-N 121.799 -0.563 . . . . 0.0 109.846 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.5 m -71.09 2.69 4.19 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 117.234 -1.365 . . . . 0.0 113.164 175.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 59.0 mm-40 -53.6 -34.24 57.73 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 121.022 1.737 . . . . 0.0 111.432 169.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.08 -56.42 22.49 Favored 'General case' 0 C--N 1.342 0.271 0 CA-C-N 119.271 0.941 . . . . 0.0 111.308 177.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.9 p -73.21 -33.22 40.99 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.025 -174.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 35.9 mt -59.25 -44.05 91.18 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.467 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 170.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.45 HE22 ' NH1' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -54.54 -34.71 62.24 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 118.332 0.515 . . . . 0.0 111.172 173.962 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -72.09 -40.17 68.41 Favored 'General case' 0 N--CA 1.427 -1.581 0 C-N-CA 118.536 -1.266 . . . . 0.0 111.158 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.5 mt -65.01 -30.5 71.49 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 119.903 1.229 . . . . 0.0 111.75 173.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.45 ' NH1' HE22 ' A' ' 33' ' ' GLN . 0.3 OUTLIER -59.95 -58.23 9.46 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 124.053 0.941 . . . . 0.0 108.879 174.735 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.48 -35.62 76.34 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 114.15 -1.386 . . . . 0.0 111.11 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 49.6 t -62.27 -50.11 72.99 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 123.52 0.728 . . . . 0.0 109.288 172.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 53.1 t -64.05 -48.07 77.72 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 123.905 0.882 . . . . 0.0 111.671 -172.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.44 ' HA ' ' HE3' ' A' ' 44' ' ' LYS . . . -67.45 -2.98 7.21 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 124.434 1.093 . . . . 0.0 112.706 -178.167 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.412 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 2.6 tp-100 -83.5 -5.87 59.29 Favored 'General case' 0 N--CA 1.439 -1.015 0 C-N-CA 124.87 1.268 . . . . 0.0 111.414 179.096 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.412 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 82.6 m-85 -138.81 161.83 56.15 Favored Pre-proline 0 N--CA 1.444 -0.767 0 C-N-CA 125.415 1.486 . . . . 0.0 110.508 -169.045 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -67.73 107.95 1.56 Allowed 'Trans proline' 0 N--CA 1.457 -0.664 0 N-CA-C 104.518 -2.916 . . . . 0.0 104.518 165.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.44 ' HE3' ' HA ' ' A' ' 40' ' ' ALA . 31.6 mmtm -38.08 -43.29 0.73 Allowed 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 117.04 2.237 . . . . 0.0 117.04 -163.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.19 -14.33 11.54 Favored Glycine 0 CA--C 1.537 1.429 0 C-N-CA 124.475 1.036 . . . . 0.0 114.109 177.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 29.1 tpt85 -48.83 -34.11 11.81 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 128.285 2.634 . . . . 0.0 112.168 170.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.3 t -138.78 140.86 38.76 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-O 121.939 0.876 . . . . 0.0 110.301 -169.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 11.8 t -69.52 -53.29 25.52 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 CA-C-N 114.413 -1.267 . . . . 0.0 108.823 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 5.0 m -61.88 -38.9 81.71 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 CA-C-O 119.297 -0.382 . . . . 0.0 110.248 -178.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 10.2 t -66.27 -38.31 87.51 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.915 0.886 . . . . 0.0 109.799 176.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.4 m -65.24 -21.07 66.69 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 118.803 -0.618 . . . . 0.0 111.309 173.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -79.01 -25.97 58.95 Favored Glycine 0 C--N 1.343 0.958 0 CA-C-O 122.173 0.874 . . . . 0.0 112.34 168.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -80.41 -44.85 18.65 Favored 'General case' 0 N--CA 1.429 -1.503 0 N-CA-C 114.85 1.426 . . . . 0.0 114.85 -165.642 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 . . . . . 0 C--N 1.319 -0.744 0 O-C-N 123.546 0.528 . . . . 0.0 110.425 173.865 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 27.2 t0 . . . . . 0 N--CA 1.444 -0.744 0 CA-C-O 118.127 -0.94 . . . . 0.0 109.245 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -55.94 -29.44 73.23 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 123.68 2.92 . . . . 0.0 113.572 -176.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 99.1 m -102.27 -8.78 20.97 Favored 'General case' 0 N--CA 1.438 -1.057 0 C-N-CA 125.857 1.663 . . . . 0.0 113.974 -168.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.1 tt0 -62.96 -26.0 68.63 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 123.454 0.702 . . . . 0.0 111.327 -179.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.9 tmtt? -61.34 -53.23 59.34 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.45 1.1 . . . . 0.0 109.977 169.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -63.61 -43.96 95.38 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.714 0.806 . . . . 0.0 109.866 -178.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -51.05 -42.03 60.26 Favored 'General case' 0 C--N 1.341 0.217 0 C-N-CA 125.227 1.411 . . . . 0.0 112.773 169.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 79.7 m -63.23 -43.53 97.82 Favored 'General case' 0 C--O 1.234 0.239 0 O-C-N 123.166 0.291 . . . . 0.0 111.114 174.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 57.1 mm-40 -59.52 -32.93 70.75 Favored 'General case' 0 C--N 1.342 0.28 0 CA-C-O 118.325 -0.845 . . . . 0.0 111.529 177.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 10.6 mm -58.42 -44.63 89.12 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.143 0 CA-C-N 119.519 1.054 . . . . 0.0 110.561 174.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 63.8 mm-40 -64.68 -51.13 64.11 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 -169.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.0 tmtt? -67.52 -39.54 85.1 Favored 'General case' 0 N--CA 1.442 -0.862 0 C-N-CA 127.536 2.334 . . . . 0.0 111.407 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 15.3 t -52.37 -44.97 65.58 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 170.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.8 -44.88 93.74 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-O 118.826 -0.607 . . . . 0.0 109.951 -178.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 -65.44 -41.34 93.58 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 119.243 0.928 . . . . 0.0 110.65 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.75 -11.87 14.21 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.069 0.948 . . . . 0.0 113.102 171.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 57.8 m-80 -125.35 10.09 7.95 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.085 1.354 . . . . 0.0 112.142 -176.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 13.1 m 53.43 42.36 32.0 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-O 122.723 1.249 . . . . 0.0 112.003 -178.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.259 6.5 m-85 73.34 13.26 4.66 Favored 'General case' 0 N--CA 1.444 -0.749 0 C-N-CA 128.431 2.692 . . . . 0.0 114.486 168.504 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 68.7 mtm -69.86 84.8 0.49 Allowed 'General case' 0 N--CA 1.441 -0.922 0 C-N-CA 124.876 1.27 . . . . 0.0 109.725 169.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -53.34 -25.1 13.83 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.828 0.851 . . . . 0.0 111.337 170.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.5 m -51.16 -40.47 58.67 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 126.631 1.972 . . . . 0.0 112.587 170.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 54.2 mmtt -74.52 -47.9 30.24 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.358 1.063 . . . . 0.0 108.8 175.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 82.3 m -71.65 3.21 4.22 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.905 1.282 . . . . 0.0 113.224 -176.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 41.3 mm-40 -54.8 -32.9 60.81 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 119.488 1.04 . . . . 0.0 110.151 167.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.99 -58.89 6.17 Favored 'General case' 0 C--N 1.345 0.408 0 C-N-CA 124.977 1.311 . . . . 0.0 111.333 175.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 10.6 p -69.85 -32.27 51.27 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 C-N-CA 124.013 0.925 . . . . 0.0 109.761 -174.206 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 72.4 mt -60.42 -48.28 89.02 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 N-CA-C 107.106 -1.442 . . . . 0.0 107.106 170.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.426 HE22 ' NH1' ' A' ' 36' ' ' ARG . 1.6 tp-100 -59.26 -20.39 53.84 Favored 'General case' 0 N--CA 1.439 -0.976 0 O-C-N 121.08 -1.013 . . . . 0.0 112.692 175.589 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.3 tp10 -80.36 -34.93 36.13 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 120.366 1.439 . . . . 0.0 111.83 169.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.9 mt -58.82 -27.13 64.8 Favored 'General case' 0 C--N 1.345 0.399 0 CA-C-N 120.298 1.408 . . . . 0.0 109.456 172.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.426 ' NH1' HE22 ' A' ' 33' ' ' GLN . 18.3 mmt85 -64.17 -52.22 60.02 Favored 'General case' 0 CA--C 1.52 -0.206 0 C-N-CA 123.915 0.886 . . . . 0.0 109.487 176.362 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -67.99 -28.09 67.13 Favored 'General case' 0 C--O 1.235 0.304 0 O-C-N 123.572 0.545 . . . . 0.0 111.036 -177.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 49.8 t -68.11 -53.0 28.59 Favored 'General case' 0 N--CA 1.438 -1.041 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 168.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 51.8 t -64.12 -50.53 67.9 Favored 'General case' 0 CA--C 1.515 -0.389 0 C-N-CA 124.33 1.052 . . . . 0.0 112.381 -169.332 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.93 0.95 3.81 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.708 0.803 . . . . 0.0 112.613 -173.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.539 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 9.5 tt0 -82.82 -11.17 58.45 Favored 'General case' 0 N--CA 1.439 -1.008 0 C-N-CA 126.721 2.008 . . . . 0.0 110.855 176.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.539 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 77.1 m-85 -139.92 162.02 52.79 Favored Pre-proline 0 N--CA 1.445 -0.677 0 C-N-CA 125.125 1.37 . . . . 0.0 111.877 -168.093 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.43 144.77 46.22 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 N-CA-C 107.692 -1.696 . . . . 0.0 107.692 166.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 55.3 tttp -52.23 -40.73 62.02 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 114.189 1.181 . . . . 0.0 114.189 -170.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -64.92 -7.63 30.81 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 124.016 0.817 . . . . 0.0 113.604 -179.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.3 tpm_? -70.33 -21.16 62.94 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 118.957 1.379 . . . . 0.0 111.61 172.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.8 t -150.69 135.18 17.17 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-O 122.982 1.372 . . . . 0.0 112.867 -169.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 13.4 t -67.43 -52.57 40.4 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 CA-C-N 113.39 -1.732 . . . . 0.0 108.449 175.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 3.1 m -64.28 -41.82 93.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 CA-C-O 118.321 -0.847 . . . . 0.0 109.923 -176.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 43.9 t -64.53 -30.51 71.53 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.708 1.603 . . . . 0.0 110.019 177.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 48.9 m -67.01 -32.37 73.56 Favored 'General case' 0 CA--C 1.536 0.41 0 O-C-N 121.682 -0.636 . . . . 0.0 110.903 170.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.51 -33.36 84.44 Favored Glycine 0 C--N 1.344 0.985 0 CA-C-O 123.033 1.352 . . . . 0.0 111.397 168.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -81.03 -45.35 16.69 Favored 'General case' 0 N--CA 1.423 -1.812 0 N-CA-C 115.785 1.772 . . . . 0.0 115.785 -165.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 . . . . . 0 CA--C 1.541 0.634 0 CA-C-O 119.121 -0.466 . . . . 0.0 110.219 169.911 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 41.9 t0 . . . . . 0 N--CA 1.449 -0.497 0 CA-C-O 118.33 -0.843 . . . . 0.0 108.895 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -56.68 -35.75 97.75 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 123.626 2.884 . . . . 0.0 112.211 -173.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 95.0 m -92.89 -7.96 44.7 Favored 'General case' 0 N--CA 1.442 -0.843 0 C-N-CA 126.246 1.818 . . . . 0.0 113.49 -168.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.6 tp60 -61.66 -24.78 66.96 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 117.966 0.348 . . . . 0.0 110.592 179.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 61.1 tttm -56.98 -60.01 4.21 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 125.209 1.404 . . . . 0.0 109.758 167.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 19.8 mp0 -57.81 -45.6 85.86 Favored 'General case' 0 C--O 1.225 -0.204 0 C-N-CA 123.88 0.872 . . . . 0.0 110.206 -176.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -52.54 -41.82 63.84 Favored 'General case' 0 C--N 1.338 0.096 0 C-N-CA 125.055 1.342 . . . . 0.0 112.697 173.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 92.4 m -61.69 -47.51 84.98 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 117.706 0.23 . . . . 0.0 110.609 172.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -62.21 -24.51 67.26 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-O 117.8 -1.095 . . . . 0.0 112.262 -179.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 35.8 mm -56.05 -53.4 39.12 Favored 'Isoleucine or valine' 0 C--N 1.343 0.29 0 CA-C-N 120.126 1.33 . . . . 0.0 109.624 172.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -58.73 -54.35 48.03 Favored 'General case' 0 N--CA 1.445 -0.68 0 O-C-N 124.025 0.828 . . . . 0.0 109.196 -179.484 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -66.7 -31.98 73.0 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 119.132 -1.027 . . . . 0.0 111.675 -174.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 20.4 t -56.48 -48.74 76.48 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 119.362 0.983 . . . . 0.0 108.681 169.23 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.05 -46.88 84.65 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 123.178 0.591 . . . . 0.0 110.429 179.461 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -56.98 -46.28 82.35 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.663 0.785 . . . . 0.0 111.258 174.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.59 -12.74 55.82 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.127 0.971 . . . . 0.0 113.475 175.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.3 m-80 -123.87 8.65 8.75 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.65 1.18 . . . . 0.0 112.149 -173.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 58.23 40.27 24.94 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 122.376 1.084 . . . . 0.0 110.873 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.262 7.1 m-85 71.97 14.08 5.87 Favored 'General case' 0 N--CA 1.444 -0.764 0 C-N-CA 127.876 2.47 . . . . 0.0 114.66 168.8 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 65.8 mtm -69.62 86.26 0.47 Allowed 'General case' 0 N--CA 1.443 -0.823 0 C-N-CA 125.147 1.379 . . . . 0.0 109.982 169.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -53.37 -25.87 17.14 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.414 0.686 . . . . 0.0 111.4 169.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.9 m -53.4 -38.66 63.63 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.834 2.054 . . . . 0.0 112.709 171.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.6 mmtm -73.98 -47.95 33.69 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 124.224 1.01 . . . . 0.0 108.58 173.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.2 m -73.09 2.7 6.6 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 124.753 1.221 . . . . 0.0 113.567 -173.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 27.1 mm-40 -54.49 -28.44 44.82 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 119.604 1.093 . . . . 0.0 110.08 167.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.73 -58.44 8.57 Favored 'General case' 0 C--N 1.348 0.504 0 C-N-CA 126.087 1.755 . . . . 0.0 111.955 172.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.6 p -72.59 -30.28 33.4 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 C-N-CA 123.873 0.869 . . . . 0.0 110.074 -174.002 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 75.9 mt -59.18 -48.76 85.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 N-CA-C 106.229 -1.767 . . . . 0.0 106.229 168.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.1 -25.8 59.38 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 121.014 -1.054 . . . . 0.0 113.454 174.048 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 49.6 tt0 -75.08 -39.78 60.55 Favored 'General case' 0 N--CA 1.434 -1.249 0 C-N-CA 119.353 -0.939 . . . . 0.0 110.486 174.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.4 mt -57.95 -31.92 67.31 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-O 117.863 -1.065 . . . . 0.0 109.304 169.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 19.1 mmt85 -66.19 -56.9 9.06 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 120.143 1.338 . . . . 0.0 109.145 -178.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 12.3 ptmm? -67.94 -22.19 65.06 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.651 -176.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.4 t -73.16 -51.92 16.07 Favored 'General case' 0 N--CA 1.439 -1.013 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 166.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 43.1 t -60.82 -52.27 65.79 Favored 'General case' 0 CA--C 1.514 -0.442 0 C-N-CA 124.404 1.082 . . . . 0.0 112.16 -170.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.16 1.67 4.5 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.382 -0.826 . . . . 0.0 112.554 -173.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.53 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 11.6 tt0 -85.29 -11.7 54.12 Favored 'General case' 0 N--CA 1.44 -0.944 0 C-N-CA 126.451 1.9 . . . . 0.0 111.168 -179.127 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.53 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 73.8 m-85 -135.37 160.48 67.8 Favored Pre-proline 0 N--CA 1.447 -0.623 0 C-N-CA 124.907 1.283 . . . . 0.0 111.168 -168.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -65.07 120.38 7.6 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 N-CA-C 105.416 -2.571 . . . . 0.0 105.416 165.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -43.79 -40.05 4.15 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 115.158 1.54 . . . . 0.0 115.158 -167.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.58 -9.71 14.18 Favored Glycine 0 CA--C 1.533 1.202 0 C-N-CA 124.845 1.212 . . . . 0.0 114.048 178.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.43 -26.65 68.83 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 119.06 1.43 . . . . 0.0 111.478 169.517 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 11.1 t -140.23 132.12 27.63 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-O 123.235 1.493 . . . . 0.0 112.727 -169.066 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 19.1 t -68.52 -52.06 40.25 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.655 0 CA-C-N 112.762 -2.017 . . . . 0.0 108.365 175.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 12.4 m -62.86 -41.86 94.23 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 CA-C-O 118.363 -0.827 . . . . 0.0 110.313 -176.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 29.3 t -63.66 -34.11 77.12 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.669 1.588 . . . . 0.0 110.183 176.161 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.9 m -67.65 -28.72 67.96 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 122.854 0.462 . . . . 0.0 110.708 171.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -67.89 -34.03 81.29 Favored Glycine 0 C--N 1.346 1.107 0 CA-C-O 123.15 1.417 . . . . 0.0 111.315 167.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -80.38 -44.34 19.56 Favored 'General case' 0 N--CA 1.421 -1.914 0 N-CA-C 115.877 1.806 . . . . 0.0 115.877 -165.64 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 . . . . . 0 C--N 1.322 -0.611 0 CA-C-O 118.779 -0.629 . . . . 0.0 110.393 170.882 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.2 t0 . . . . . 0 N--CA 1.448 -0.566 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -55.45 -33.53 86.26 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 124.204 3.269 . . . . 0.0 112.821 -175.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 63.1 m -94.61 -10.41 32.04 Favored 'General case' 0 N--CA 1.438 -1.068 0 C-N-CA 125.599 1.56 . . . . 0.0 113.19 -169.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 26.5 tp60 -62.6 -24.94 67.83 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 118.806 0.73 . . . . 0.0 111.161 -179.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -60.1 -54.38 46.58 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.434 1.094 . . . . 0.0 109.988 168.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -63.64 -38.83 92.62 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.655 0.782 . . . . 0.0 110.242 -177.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.14 -43.46 70.55 Favored 'General case' 0 C--N 1.341 0.197 0 C-N-CA 124.98 1.312 . . . . 0.0 112.645 169.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 77.8 m -57.56 -44.71 85.48 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 121.228 -0.189 . . . . 0.0 110.731 173.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -62.01 -25.81 67.87 Favored 'General case' 0 C--O 1.226 -0.137 0 CA-C-O 117.779 -1.105 . . . . 0.0 112.14 178.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 22.9 mm -59.38 -54.18 37.94 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.288 0 CA-C-N 120.251 1.387 . . . . 0.0 109.393 173.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -59.47 -53.45 58.05 Favored 'General case' 0 N--CA 1.445 -0.708 0 O-C-N 123.991 0.807 . . . . 0.0 109.014 -178.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.47 -31.99 72.52 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 118.987 -1.085 . . . . 0.0 111.664 -175.585 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.0 t -55.82 -48.03 76.16 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 119.42 1.009 . . . . 0.0 108.728 168.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.14 -47.24 83.93 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 123.279 0.632 . . . . 0.0 110.277 179.123 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -56.92 -46.25 82.12 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.45 0.7 . . . . 0.0 111.3 174.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.4 -13.97 59.86 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.017 0.927 . . . . 0.0 113.301 175.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.4 m-80 -124.13 10.32 8.73 Favored 'General case' 0 C--N 1.342 0.278 0 C-N-CA 124.458 1.103 . . . . 0.0 112.121 -173.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 14.8 m 58.22 39.99 25.24 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 119.825 1.193 . . . . 0.0 111.129 178.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.275 6.9 m-85 73.27 14.76 4.47 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 127.902 2.481 . . . . 0.0 114.774 168.635 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 50.6 mtm -66.57 85.15 0.11 Allowed 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 125.677 1.591 . . . . 0.0 110.251 169.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -56.95 -18.18 12.48 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.609 1.164 . . . . 0.0 112.157 170.124 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.4 p -61.5 -58.27 8.83 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 127.138 2.175 . . . . 0.0 110.797 167.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.5 mmtp -54.43 -41.0 68.88 Favored 'General case' 0 C--N 1.339 0.121 0 C-N-CA 123.392 0.677 . . . . 0.0 109.415 173.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.3 m -80.65 7.12 10.84 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -176.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 79.6 mm-40 -59.35 -27.42 65.92 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.833 1.197 . . . . 0.0 110.841 167.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.22 -54.3 48.41 Favored 'General case' 0 C--N 1.345 0.379 0 C-N-CA 125.513 1.525 . . . . 0.0 111.63 173.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.2 p -76.58 -28.74 17.88 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.811 0 C-N-CA 123.69 0.796 . . . . 0.0 109.838 -175.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 22.4 mt -59.74 -46.41 93.53 Favored 'Isoleucine or valine' 0 C--N 1.344 0.335 0 N-CA-C 107.034 -1.469 . . . . 0.0 107.034 167.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.34 -30.33 51.1 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 123.166 0.586 . . . . 0.0 112.358 173.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -78.18 -39.73 39.88 Favored 'General case' 0 N--CA 1.429 -1.518 0 C-N-CA 120.232 -0.587 . . . . 0.0 111.633 177.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.9 mt -63.65 -33.02 74.7 Favored 'General case' 0 C--N 1.343 0.315 0 CA-C-N 119.559 1.072 . . . . 0.0 110.362 172.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.12 -61.92 2.2 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.942 1.297 . . . . 0.0 109.406 175.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.9 ptmt -65.92 -29.76 70.23 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 114.51 -1.223 . . . . 0.0 110.888 -174.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 52.1 t -62.56 -51.21 68.27 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 168.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.6 t -60.54 -46.75 89.03 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.324 0.65 . . . . 0.0 111.309 -173.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.73 -1.94 4.42 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 125.097 1.359 . . . . 0.0 113.247 -179.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.522 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 21.0 tt0 -80.18 -10.87 59.78 Favored 'General case' 0 N--CA 1.44 -0.969 0 C-N-CA 123.969 0.907 . . . . 0.0 110.591 172.293 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.522 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 68.3 m-85 -139.37 161.06 59.25 Favored Pre-proline 0 N--CA 1.447 -0.613 0 C-N-CA 124.556 1.143 . . . . 0.0 112.476 -168.454 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -68.21 123.49 10.65 Favored 'Trans proline' 0 N--CA 1.457 -0.675 0 N-CA-C 104.814 -2.802 . . . . 0.0 104.814 164.095 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.0 ptmt -48.97 -33.63 11.37 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 116.5 2.037 . . . . 0.0 116.5 -166.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.85 -15.05 40.28 Favored Glycine 0 CA--C 1.532 1.134 0 CA-C-N 118.899 0.772 . . . . 0.0 113.806 178.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.8 tpm_? -64.58 -12.95 50.44 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 125.223 1.409 . . . . 0.0 112.457 171.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.9 t -149.93 141.09 23.07 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 122.478 1.132 . . . . 0.0 111.756 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.5 t -71.8 -54.12 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 CA-C-N 114.571 -1.195 . . . . 0.0 108.913 178.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 6.8 m -59.52 -39.46 79.38 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 122.63 0.372 . . . . 0.0 110.085 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 12.2 t -67.54 -37.23 82.4 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.686 1.195 . . . . 0.0 110.176 177.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 54.1 m -63.7 -27.83 69.48 Favored 'General case' 0 N--CA 1.453 -0.32 0 O-C-N 121.883 -0.511 . . . . 0.0 110.87 172.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.29 -25.47 72.96 Favored Glycine 0 C--N 1.343 0.958 0 CA-C-O 122.025 0.791 . . . . 0.0 112.195 170.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -82.35 -49.45 10.01 Favored 'General case' 0 N--CA 1.433 -1.309 0 C-N-CA 126.087 1.755 . . . . 0.0 115.12 -167.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 . . . . . 0 C--N 1.32 -0.676 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.105 172.787 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.8 t0 . . . . . 0 N--CA 1.447 -0.586 0 N-CA-C 106.369 -1.715 . . . . 0.0 106.369 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -56.01 -37.04 96.75 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 123.536 2.824 . . . . 0.0 112.362 -169.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 67.5 m -92.92 -8.86 42.03 Favored 'General case' 0 N--CA 1.438 -1.053 0 C-N-CA 125.707 1.603 . . . . 0.0 113.396 -168.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 28.8 tp60 -62.27 -25.05 67.63 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 118.321 0.509 . . . . 0.0 110.51 178.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.3 tmtm? -58.27 -56.93 15.69 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.387 1.075 . . . . 0.0 109.446 168.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 21.1 mp0 -61.96 -39.13 91.07 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.037 0.935 . . . . 0.0 110.749 -177.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -55.27 -44.83 76.0 Favored 'General case' 0 C--N 1.338 0.108 0 C-N-CA 124.319 1.048 . . . . 0.0 112.203 170.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.4 m -59.02 -41.65 88.28 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 121.06 -0.256 . . . . 0.0 111.078 172.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -64.26 -21.96 66.78 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-O 117.432 -1.27 . . . . 0.0 112.941 176.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 44.3 mm -59.64 -51.1 76.74 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-N 121.029 1.74 . . . . 0.0 109.34 172.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 8.4 mm-40 -61.14 -55.89 27.19 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 108.274 -1.009 . . . . 0.0 108.274 178.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 17.7 mtpp -66.2 -27.84 68.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 118.405 -0.807 . . . . 0.0 111.481 -172.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 15.7 t -56.71 -51.36 69.1 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 119.14 0.882 . . . . 0.0 109.034 168.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.05 -46.71 78.83 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 123.524 0.729 . . . . 0.0 110.723 178.061 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.448 ' HA ' ' CE1' ' A' ' 23' ' ' TYR . 1.5 mp0 -56.86 -44.49 82.23 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 122.908 0.483 . . . . 0.0 111.635 174.883 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.18 -14.38 61.79 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 177.061 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -120.89 14.19 11.55 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.362 1.065 . . . . 0.0 113.248 -168.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 17.2 m 60.98 35.98 18.81 Favored 'General case' 0 C--N 1.346 0.442 0 CA-C-N 120.55 1.523 . . . . 0.0 110.035 -178.244 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.448 ' CE1' ' HA ' ' A' ' 19' ' ' GLN . 45.4 m-85 66.63 16.68 10.46 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 126.516 1.926 . . . . 0.0 113.597 168.555 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 58.0 mtm -72.27 88.04 1.14 Allowed 'General case' 0 N--CA 1.438 -1.039 0 C-N-CA 126.36 1.864 . . . . 0.0 108.808 173.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -52.85 -27.97 20.78 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.016 0.927 . . . . 0.0 110.532 170.577 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.0 m -57.22 -35.94 70.28 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 127.184 2.194 . . . . 0.0 113.325 171.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.5 mmtm -72.82 -43.5 62.6 Favored 'General case' 0 C--O 1.233 0.214 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 170.595 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . 0.25 74.7 m -73.42 1.42 9.77 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 123.875 0.87 . . . . 0.0 113.116 -170.495 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 61.6 mm-40 -55.56 -31.87 62.53 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.319 -0.863 . . . . 0.0 109.919 165.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.97 -53.48 57.78 Favored 'General case' 0 C--N 1.346 0.423 0 C-N-CA 124.531 1.132 . . . . 0.0 111.684 173.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.5 p -75.97 -24.47 16.6 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 C-N-CA 122.863 0.465 . . . . 0.0 110.245 -174.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 40.3 mt -62.53 -49.38 84.05 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 N-CA-C 106.561 -1.644 . . . . 0.0 106.561 167.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -55.92 -29.9 60.8 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 118.94 0.791 . . . . 0.0 111.142 174.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -71.42 -44.19 65.34 Favored 'General case' 0 N--CA 1.446 -0.628 0 O-C-N 121.313 -0.867 . . . . 0.0 112.288 175.16 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.405 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.3 mt -59.77 -33.44 71.7 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-N 119.038 0.835 . . . . 0.0 109.777 172.132 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.6 ttt-85 -62.21 -57.01 13.04 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 126.052 1.741 . . . . 0.0 110.629 178.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -62.9 -35.64 80.71 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 124.486 1.114 . . . . 0.0 110.872 -179.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.3 t -62.38 -50.27 72.24 Favored 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 169.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 52.6 t -63.94 -48.93 74.59 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 123.2 0.6 . . . . 0.0 111.724 -170.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.4 -0.65 5.14 Favored 'General case' 0 N--CA 1.444 -0.737 0 C-N-CA 124.575 1.15 . . . . 0.0 112.091 -177.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.435 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 2.1 tp-100 -80.06 -7.49 58.89 Favored 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 123.797 0.839 . . . . 0.0 110.963 173.475 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.435 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 73.3 m-85 -143.28 161.36 48.1 Favored Pre-proline 0 N--CA 1.444 -0.749 0 C-N-CA 124.286 1.035 . . . . 0.0 112.472 -168.74 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -69.24 110.15 2.38 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 N-CA-C 105.284 -2.622 . . . . 0.0 105.284 164.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -43.52 -30.49 0.58 Allowed 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 117.937 2.569 . . . . 0.0 117.937 -166.584 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -55.39 -16.44 9.98 Favored Glycine 0 CA--C 1.538 1.5 0 CA-C-N 119.559 1.072 . . . . 0.0 114.071 172.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 12.7 tpt180 -54.12 -28.22 38.22 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 127.062 2.145 . . . . 0.0 111.789 168.432 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.2 t -146.63 140.89 26.35 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-O 122.483 1.135 . . . . 0.0 112.36 -169.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 11.7 t -69.26 -55.66 14.54 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-N 114.107 -1.406 . . . . 0.0 108.941 178.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 7.6 m -59.21 -41.72 84.73 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 122.897 0.479 . . . . 0.0 109.915 -177.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 14.0 t -67.33 -35.55 79.64 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.967 1.307 . . . . 0.0 110.044 179.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 54.7 m -65.95 -23.63 66.64 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 118.734 -0.651 . . . . 0.0 111.156 172.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -77.12 -26.91 61.0 Favored Glycine 0 C--N 1.345 1.04 0 CA-C-O 122.423 1.013 . . . . 0.0 111.832 168.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.405 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.4 OUTLIER -80.15 -41.54 25.18 Favored 'General case' 0 N--CA 1.42 -1.958 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 -166.8 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 . . . . . 0 C--N 1.322 -0.621 0 O-C-N 123.883 0.739 . . . . 0.0 111.164 177.975 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.2 t0 . . . . . 0 CA--C 1.539 0.533 0 N-CA-C 106.148 -1.797 . . . . 0.0 106.148 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo -62.04 -30.67 83.24 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 124.318 3.345 . . . . 0.0 112.685 -172.131 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 89.9 m -93.29 -14.17 27.3 Favored 'General case' 0 N--CA 1.437 -1.076 0 C-N-CA 124.863 1.265 . . . . 0.0 112.299 -168.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 21.4 tp60 -60.48 -25.53 66.12 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 123.432 0.693 . . . . 0.0 110.739 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 65.9 tttp -62.08 -56.85 14.71 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 124.14 0.976 . . . . 0.0 110.162 168.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -61.15 -37.7 83.79 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.788 0.835 . . . . 0.0 110.481 -176.355 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.49 -43.64 71.96 Favored 'General case' 0 CA--C 1.52 -0.195 0 C-N-CA 125.186 1.394 . . . . 0.0 112.826 169.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.8 m -58.75 -43.86 90.39 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 121.028 0.442 . . . . 0.0 110.817 173.092 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 40.2 mm-40 -64.27 -21.1 66.47 Favored 'General case' 0 N--CA 1.456 -0.151 0 CA-C-O 117.735 -1.126 . . . . 0.0 112.387 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 36.8 mm -60.12 -52.62 59.1 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 CA-C-N 120.574 1.534 . . . . 0.0 109.363 171.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -58.27 -55.52 33.96 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 107.624 -1.251 . . . . 0.0 107.624 -179.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 41.1 mtpt -70.02 -29.44 66.5 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 118.201 -0.904 . . . . 0.0 111.64 -170.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.8 t -56.87 -47.05 81.36 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 168.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.15 -45.45 90.93 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 118.377 -0.82 . . . . 0.0 110.133 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -58.47 -46.53 86.42 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 119.428 1.013 . . . . 0.0 111.222 174.228 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.05 -14.57 55.41 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.811 0.844 . . . . 0.0 113.24 176.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -122.56 9.16 9.58 Favored 'General case' 0 C--N 1.342 0.256 0 C-N-CA 124.228 1.011 . . . . 0.0 112.231 -173.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.6 m 58.25 40.23 24.91 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 122.601 1.191 . . . . 0.0 110.776 179.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.26 7.1 m-85 72.14 15.1 5.53 Favored 'General case' 0 N--CA 1.443 -0.812 0 C-N-CA 127.914 2.485 . . . . 0.0 114.316 169.075 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 67.3 mtm -70.44 86.82 0.62 Allowed 'General case' 0 N--CA 1.441 -0.915 0 C-N-CA 125.5 1.52 . . . . 0.0 110.047 169.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -55.05 -23.47 20.19 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 125.769 1.628 . . . . 0.0 110.569 168.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -55.26 -41.53 72.31 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.864 1.665 . . . . 0.0 112.004 169.576 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 50.6 mmtt -73.7 -45.68 50.83 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.991 0.916 . . . . 0.0 108.555 175.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.1 m -73.68 1.6 9.92 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -172.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 65.4 mm-40 -51.81 -34.57 40.72 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 119.105 0.866 . . . . 0.0 109.986 166.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.68 -57.4 12.9 Favored 'General case' 0 C--N 1.346 0.425 0 C-N-CA 125.757 1.623 . . . . 0.0 111.447 175.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.7 p -72.44 -29.79 32.45 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.645 0 C-N-CA 123.618 0.767 . . . . 0.0 110.194 -173.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 56.2 mt -59.97 -50.66 79.27 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 N-CA-C 106.129 -1.804 . . . . 0.0 106.129 168.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.51 HE22 ' NH1' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -56.91 -28.84 62.47 Favored 'General case' 0 N--CA 1.448 -0.574 0 O-C-N 121.635 -0.666 . . . . 0.0 112.77 175.306 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -74.99 -37.94 61.74 Favored 'General case' 0 N--CA 1.432 -1.361 0 CA-C-N 118.585 0.63 . . . . 0.0 111.39 177.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.4 mt -59.27 -34.11 71.86 Favored 'General case' 0 C--N 1.346 0.418 0 CA-C-N 119.502 1.046 . . . . 0.0 109.872 169.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.51 ' NH1' HE22 ' A' ' 33' ' ' GLN . 0.8 OUTLIER -67.13 -55.62 13.43 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.214 1.406 . . . . 0.0 111.732 179.722 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 57.4 mttm -62.09 -33.31 74.19 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 124.822 1.249 . . . . 0.0 110.326 178.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.3 t -64.2 -52.76 57.29 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 168.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.4 t -57.7 -50.31 73.63 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 123.762 0.825 . . . . 0.0 112.079 -172.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.79 -0.87 7.84 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 114.961 -1.018 . . . . 0.0 112.444 -175.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.434 ' HB3' ' CE1' ' A' ' 42' ' ' TYR . 2.7 tp-100 -85.38 -6.57 59.21 Favored 'General case' 0 N--CA 1.437 -1.111 0 C-N-CA 124.345 1.058 . . . . 0.0 111.548 179.408 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.434 ' CE1' ' HB3' ' A' ' 41' ' ' GLN . 77.9 m-85 -140.26 160.23 60.68 Favored Pre-proline 0 N--CA 1.445 -0.685 0 C-N-CA 124.472 1.109 . . . . 0.0 111.609 -168.7 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -67.37 118.17 5.38 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 N-CA-C 106.408 -2.189 . . . . 0.0 106.408 166.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 62.1 tttm -41.27 -38.15 1.1 Allowed 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 117.024 2.231 . . . . 0.0 117.024 -168.019 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.28 -13.62 16.28 Favored Glycine 0 CA--C 1.537 1.418 0 C-N-CA 123.997 0.808 . . . . 0.0 114.066 176.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.77 -31.12 64.3 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 126.381 1.872 . . . . 0.0 112.057 169.495 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.5 t -146.01 136.97 24.5 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-O 123.113 1.435 . . . . 0.0 113.798 -168.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.1 t -71.89 -54.57 16.37 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.735 0 CA-C-N 112.726 -2.034 . . . . 0.0 108.833 177.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 17.7 m -60.19 -39.36 80.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 C-N-CA 123.004 0.522 . . . . 0.0 110.558 -178.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 6.3 t -66.54 -38.9 88.13 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.102 1.361 . . . . 0.0 109.954 176.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 51.2 m -64.88 -26.64 68.41 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-O 119.231 -0.414 . . . . 0.0 110.822 172.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.34 -26.47 71.92 Favored Glycine 0 C--N 1.342 0.915 0 CA-C-N 118.088 0.404 . . . . 0.0 112.291 169.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -81.2 -48.11 12.52 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 115.893 1.812 . . . . 0.0 115.893 -165.737 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 . . . . . 0 C--N 1.32 -0.678 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.243 173.5 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.9 t0 . . . . . 0 N--CA 1.442 -0.827 0 N-CA-C 105.964 -1.865 . . . . 0.0 105.964 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -53.56 -31.51 59.59 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 124.363 3.375 . . . . 0.0 112.868 -169.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 73.0 m -94.26 -13.69 26.27 Favored 'General case' 0 N--CA 1.428 -1.553 0 C-N-CA 126.384 1.874 . . . . 0.0 112.735 -170.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 32.3 tp60 -63.11 -25.58 68.43 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 118.898 0.772 . . . . 0.0 110.767 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -60.37 -53.62 55.45 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.979 0.912 . . . . 0.0 110.191 169.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -64.86 -38.97 92.74 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.249 0.62 . . . . 0.0 110.155 -178.162 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.07 -45.33 71.7 Favored 'General case' 0 C--N 1.341 0.216 0 C-N-CA 125.186 1.394 . . . . 0.0 112.061 169.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 89.1 m -57.33 -43.05 83.05 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 117.632 0.196 . . . . 0.0 110.473 173.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -65.06 -25.29 67.75 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-O 117.547 -1.216 . . . . 0.0 113.053 176.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 30.2 mm -58.71 -52.01 65.1 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 CA-C-N 120.677 1.581 . . . . 0.0 108.961 171.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -60.8 -53.5 56.65 Favored 'General case' 0 N--CA 1.442 -0.862 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 -175.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 16.2 mtpp -69.28 -31.1 69.38 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 118.215 -0.898 . . . . 0.0 111.849 -174.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.9 t -56.87 -45.9 82.18 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 169.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.6 -45.26 92.44 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-O 118.481 -0.771 . . . . 0.0 110.467 179.162 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -58.43 -44.81 89.26 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 119.219 0.918 . . . . 0.0 111.314 173.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.24 -13.46 58.38 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 113.345 0.869 . . . . 0.0 113.345 175.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 -124.82 9.35 8.22 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 124.483 1.113 . . . . 0.0 112.405 -172.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.3 m 58.04 40.12 25.69 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 122.318 1.056 . . . . 0.0 110.862 179.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.258 6.7 m-85 72.23 13.35 5.71 Favored 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 127.854 2.462 . . . . 0.0 114.661 168.737 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 67.3 mtm -70.78 85.87 0.67 Allowed 'General case' 0 N--CA 1.442 -0.851 0 C-N-CA 125.039 1.336 . . . . 0.0 109.798 170.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -53.58 -25.85 19.08 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.178 0.591 . . . . 0.0 111.45 171.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.1 m -51.09 -42.02 60.36 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 126.13 1.772 . . . . 0.0 112.317 170.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 55.1 mmtt -70.89 -47.59 58.34 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 124.188 0.995 . . . . 0.0 108.93 174.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.2 m -72.7 2.71 6.07 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 124.662 1.185 . . . . 0.0 113.171 -174.408 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 52.4 mm-40 -56.23 -28.25 57.78 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 119.814 1.188 . . . . 0.0 109.874 166.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.97 -56.24 24.33 Favored 'General case' 0 C--N 1.346 0.44 0 C-N-CA 125.313 1.445 . . . . 0.0 111.833 172.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.1 p -75.74 -26.02 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.746 0 C-N-CA 123.625 0.77 . . . . 0.0 109.826 -174.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 57.6 mt -62.75 -44.3 99.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 N-CA-C 107.309 -1.367 . . . . 0.0 107.309 168.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.521 HE22 ' NH1' ' A' ' 36' ' ' ARG . 2.9 tp-100 -56.47 -28.33 59.4 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 123.506 0.723 . . . . 0.0 112.379 172.401 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -74.98 -44.02 50.69 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 118.571 0.623 . . . . 0.0 111.854 173.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.412 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.6 mt -63.64 -30.89 71.94 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 119.294 0.952 . . . . 0.0 110.901 175.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.521 ' NH1' HE22 ' A' ' 33' ' ' GLN . 0.2 OUTLIER -57.26 -59.29 5.34 Favored 'General case' 0 CA--C 1.519 -0.233 0 C-N-CA 124.443 1.097 . . . . 0.0 109.415 173.502 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 48.8 mttp -60.04 -37.7 80.57 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 113.751 -1.568 . . . . 0.0 110.972 -177.295 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 42.5 t -62.2 -52.18 64.84 Favored 'General case' 0 N--CA 1.442 -0.861 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 171.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.5 t -61.6 -45.26 94.84 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.532 0.733 . . . . 0.0 111.888 -171.343 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.407 ' HA ' ' HE3' ' A' ' 44' ' ' LYS . . . -69.75 -2.4 11.85 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.095 -0.957 . . . . 0.0 112.883 -177.343 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.444 ' HB3' ' CE1' ' A' ' 42' ' ' TYR . 2.6 tp-100 -86.3 -5.53 59.16 Favored 'General case' 0 N--CA 1.438 -1.027 0 C-N-CA 124.651 1.18 . . . . 0.0 111.565 -178.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.444 ' CE1' ' HB3' ' A' ' 41' ' ' GLN . 82.7 m-85 -139.38 160.89 60.03 Favored Pre-proline 0 N--CA 1.445 -0.715 0 C-N-CA 125.13 1.372 . . . . 0.0 110.708 -168.736 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -67.42 111.12 2.22 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 N-CA-C 104.574 -2.895 . . . . 0.0 104.574 165.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.407 ' HE3' ' HA ' ' A' ' 40' ' ' ALA . 36.4 mmtm -39.43 -40.54 0.84 Allowed 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 116.753 2.131 . . . . 0.0 116.753 -165.448 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.5 -11.81 11.28 Favored Glycine 0 CA--C 1.536 1.398 0 C-N-CA 124.679 1.133 . . . . 0.0 114.303 176.259 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 31.9 tpt85 -52.52 -33.83 47.06 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 127.072 2.149 . . . . 0.0 111.675 169.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.0 t -140.71 140.75 34.94 Favored 'General case' 0 N--CA 1.44 -0.966 0 CA-C-O 122.424 1.107 . . . . 0.0 111.703 -167.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 8.8 t -70.34 -54.27 19.26 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 CA-C-N 113.828 -1.533 . . . . 0.0 108.781 179.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 7.0 m -61.48 -38.05 79.19 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-O 119.211 -0.423 . . . . 0.0 110.376 -178.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 11.9 t -67.32 -37.73 83.79 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.378 1.071 . . . . 0.0 109.93 176.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 45.2 m -64.97 -27.04 68.57 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.817 -0.552 . . . . 0.0 110.649 172.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -71.36 -26.84 72.61 Favored Glycine 0 C--N 1.344 0.993 0 CA-C-O 121.74 0.633 . . . . 0.0 112.136 169.485 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.412 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -82.04 -48.18 11.73 Favored 'General case' 0 N--CA 1.432 -1.34 0 C-N-CA 126.059 1.744 . . . . 0.0 115.074 -167.153 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 . . . . . 0 CA--C 1.543 0.681 0 CA-C-O 118.732 -0.651 . . . . 0.0 110.794 172.292 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 39.5 t0 . . . . . 0 CA--C 1.541 0.63 0 CA-C-O 118.267 -0.873 . . . . 0.0 109.977 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -55.15 -32.02 78.19 Favored 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 124.37 3.38 . . . . 0.0 113.418 -176.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 66.3 m -98.53 -10.98 22.7 Favored 'General case' 0 N--CA 1.437 -1.099 0 C-N-CA 125.929 1.692 . . . . 0.0 113.36 -168.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 20.2 tp60 -64.09 -25.91 68.31 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 118.614 0.643 . . . . 0.0 111.126 -179.104 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -59.34 -55.78 30.43 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.016 0.926 . . . . 0.0 109.54 169.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -63.92 -36.05 82.67 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.539 0.735 . . . . 0.0 110.126 -177.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -60.46 -39.16 86.57 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 124.047 0.939 . . . . 0.0 112.065 174.095 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 70.9 m -58.18 -44.76 88.19 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 118.494 0.588 . . . . 0.0 110.553 171.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 30.4 mm-40 -64.58 -22.68 67.04 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 117.745 -1.122 . . . . 0.0 112.393 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 43.8 mm -58.55 -55.14 24.65 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.263 0 CA-C-N 120.377 1.444 . . . . 0.0 109.302 171.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -60.31 -53.04 62.39 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 -177.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 16.0 mtpp -68.12 -30.74 69.97 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 118.264 -0.874 . . . . 0.0 111.495 -174.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.8 t -58.49 -47.77 83.01 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 119.412 1.005 . . . . 0.0 108.657 168.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.74 -46.96 83.75 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 123.235 0.614 . . . . 0.0 110.178 179.555 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -57.42 -44.67 84.82 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.777 0.831 . . . . 0.0 111.39 173.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.72 -13.21 61.06 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 174.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 45.2 m-80 -124.25 8.46 8.51 Favored 'General case' 0 C--N 1.343 0.284 0 C-N-CA 124.515 1.126 . . . . 0.0 112.304 -172.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.1 m 59.0 40.31 22.47 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 122.44 1.115 . . . . 0.0 110.807 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.272 7.1 m-85 72.11 14.48 5.66 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 127.697 2.399 . . . . 0.0 114.649 168.636 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 60.7 mtm -69.38 84.64 0.4 Allowed 'General case' 0 N--CA 1.441 -0.875 0 C-N-CA 125.403 1.481 . . . . 0.0 110.218 169.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 51.3 tt0 -54.0 -23.18 12.45 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.066 1.347 . . . . 0.0 111.955 169.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.7 m -58.61 -47.59 83.84 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 126.114 1.765 . . . . 0.0 111.699 169.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.4 mmtm -64.64 -47.95 76.63 Favored 'General case' 0 C--N 1.342 0.244 0 C-N-CA 124.095 0.958 . . . . 0.0 108.897 175.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 71.5 m -68.95 2.13 2.9 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 124.601 1.16 . . . . 0.0 113.186 -179.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -54.58 -27.62 40.25 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 119.826 1.194 . . . . 0.0 111.598 167.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.62 -54.66 43.94 Favored 'General case' 0 C--N 1.344 0.354 0 C-N-CA 124.747 1.219 . . . . 0.0 111.936 172.155 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 10.0 p -77.62 -30.58 16.93 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.738 0 C-N-CA 123.483 0.713 . . . . 0.0 110.192 -173.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 57.9 mt -63.54 -42.26 95.52 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 169.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.531 HE22 ' NH1' ' A' ' 36' ' ' ARG . 0.1 OUTLIER -53.99 -40.47 66.96 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-N 119.981 1.264 . . . . 0.0 111.547 169.879 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -70.08 -39.82 75.36 Favored 'General case' 0 N--CA 1.435 -1.222 0 C-N-CA 118.975 -1.09 . . . . 0.0 110.345 -178.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.45 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -71.3 -27.68 63.58 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 123.654 0.782 . . . . 0.0 110.046 179.378 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.531 ' NH1' HE22 ' A' ' 33' ' ' GLN . 0.3 OUTLIER -62.25 -59.09 5.53 Favored 'General case' 0 CA--C 1.519 -0.227 0 C-N-CA 126.616 1.967 . . . . 0.0 107.714 172.053 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 58.0 mttm -59.04 -38.99 80.62 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 114.489 -1.232 . . . . 0.0 110.462 -178.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 43.7 t -59.25 -54.23 49.25 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 123.79 0.836 . . . . 0.0 108.955 172.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 47.3 t -60.42 -42.58 96.3 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 121.593 0.711 . . . . 0.0 111.922 -173.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.44 -3.35 11.04 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.787 1.235 . . . . 0.0 113.466 -179.358 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.526 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 20.7 tt0 -84.39 -9.48 58.38 Favored 'General case' 0 N--CA 1.44 -0.959 0 C-N-CA 124.381 1.073 . . . . 0.0 111.019 178.203 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.526 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 71.6 m-85 -140.37 160.98 57.53 Favored Pre-proline 0 N--CA 1.446 -0.671 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -166.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -69.66 125.83 12.66 Favored 'Trans proline' 0 N--CA 1.457 -0.633 0 N-CA-C 105.312 -2.611 . . . . 0.0 105.312 164.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 37.8 mmtt -52.91 -31.38 39.56 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 115.362 1.616 . . . . 0.0 115.362 -165.365 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.12 -13.16 26.45 Favored Glycine 0 CA--C 1.535 1.315 0 C-N-CA 124.014 0.816 . . . . 0.0 113.975 175.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.9 tpm_? -65.48 -15.38 62.59 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.481 1.912 . . . . 0.0 112.748 169.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.1 t -153.26 137.57 16.61 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 120.095 1.316 . . . . 0.0 112.612 -173.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 20.4 t -68.26 -55.65 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.658 0 CA-C-N 113.784 -1.553 . . . . 0.0 108.813 174.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 7.5 m -61.26 -43.65 96.91 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 CA-C-O 118.881 -0.581 . . . . 0.0 110.079 -174.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 11.1 t -63.87 -33.55 75.95 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.776 1.631 . . . . 0.0 110.01 178.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 61.5 m -67.1 -26.2 66.59 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 119.127 -0.463 . . . . 0.0 111.118 172.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.77 -33.4 57.89 Favored Glycine 0 C--N 1.345 1.042 0 CA-C-O 123.313 1.507 . . . . 0.0 111.055 167.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.45 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.7 OUTLIER -78.23 -41.72 33.4 Favored 'General case' 0 N--CA 1.42 -1.932 0 N-CA-C 116.318 1.969 . . . . 0.0 116.318 -164.82 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 . . . . . 0 C--N 1.321 -0.64 0 CA-C-O 118.483 -0.77 . . . . 0.0 111.675 170.95 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 40.3 t0 . . . . . 0 CA--C 1.543 0.705 0 CA-C-O 119.244 -0.408 . . . . 0.0 109.938 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.408 ' HD3' ' HE ' ' A' ' 46' ' ' ARG . 23.6 Cg_exo -66.22 -32.04 43.2 Favored 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 125.073 3.849 . . . . 0.0 112.593 -174.499 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 99.1 m -93.85 -16.05 24.46 Favored 'General case' 0 N--CA 1.437 -1.075 0 C-N-CA 124.78 1.232 . . . . 0.0 112.562 -167.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 20.7 tp60 -59.67 -25.56 64.83 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 123.731 0.812 . . . . 0.0 111.114 177.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 51.5 tttm -61.03 -57.27 13.28 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.629 1.172 . . . . 0.0 110.097 168.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -61.64 -40.24 94.21 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.687 0.795 . . . . 0.0 110.392 -176.437 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.01 -45.89 52.33 Favored 'General case' 0 C--N 1.341 0.204 0 C-N-CA 125.334 1.454 . . . . 0.0 112.226 169.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 86.4 m -59.54 -45.46 91.72 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.738 -0.21 . . . . 0.0 110.642 175.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -60.4 -30.68 69.75 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 118.534 -0.746 . . . . 0.0 111.529 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.1 mt -64.8 -49.56 79.5 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.568 0 CA-C-N 119.451 1.023 . . . . 0.0 110.316 177.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.8 mm-40 -54.66 -56.06 23.12 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 124.118 0.886 . . . . 0.0 109.127 176.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 7.9 mptt -66.02 -33.29 75.48 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 119.592 -0.843 . . . . 0.0 111.878 -176.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 13.1 t -54.11 -49.16 69.77 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-N 119.22 0.918 . . . . 0.0 108.536 168.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.55 -47.49 84.06 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 123.878 0.871 . . . . 0.0 110.126 179.022 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -56.23 -46.94 79.33 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.603 0.761 . . . . 0.0 111.223 174.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.35 -13.2 60.24 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.1 0.96 . . . . 0.0 113.556 176.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -121.68 8.02 10.02 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.674 1.19 . . . . 0.0 111.989 -173.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 59.12 40.18 22.18 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 122.392 1.091 . . . . 0.0 110.694 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.265 7.5 m-85 72.05 14.72 5.69 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 127.911 2.485 . . . . 0.0 114.635 168.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 63.5 mtm -68.82 85.44 0.32 Allowed 'General case' 0 N--CA 1.44 -0.964 0 C-N-CA 125.086 1.354 . . . . 0.0 110.117 169.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -55.54 -19.31 9.53 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.568 1.147 . . . . 0.0 111.456 169.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.6 m -59.28 -40.71 86.99 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 127.314 2.246 . . . . 0.0 112.1 169.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.2 mmtm -73.33 -47.13 45.05 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 124.409 1.084 . . . . 0.0 108.764 175.155 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 76.3 m -73.53 6.82 2.75 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 125.211 1.404 . . . . 0.0 112.458 -177.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 61.5 mm-40 -53.85 -37.42 63.64 Favored 'General case' 0 C--N 1.341 0.206 0 O-C-N 120.858 -1.151 . . . . 0.0 110.601 167.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.32 -51.33 69.97 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.919 0.888 . . . . 0.0 111.706 179.132 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 5.8 p -75.69 -26.34 17.99 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.775 0 C-N-CA 123.084 0.554 . . . . 0.0 110.199 -176.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 58.2 mt -62.22 -49.79 82.61 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 167.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.617 HE21 ' NH2' ' A' ' 36' ' ' ARG . 2.0 tt0 -54.87 -33.26 61.71 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 118.962 0.801 . . . . 0.0 111.66 175.37 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -68.6 -41.81 79.07 Favored 'General case' 0 N--CA 1.441 -0.918 0 CA-C-O 119.024 -0.512 . . . . 0.0 111.87 174.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.6 mt -63.57 -37.1 86.04 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 117.203 -1.38 . . . . 0.0 110.984 173.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.617 ' NH2' HE21 ' A' ' 33' ' ' GLN . 2.1 ptt180 -69.1 -40.93 78.09 Favored 'General case' 0 C--N 1.344 0.328 0 CA-C-N 120.625 1.557 . . . . 0.0 109.952 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -63.07 -41.48 99.45 Favored 'General case' 0 C--N 1.341 0.235 0 CA-C-O 119.457 -0.306 . . . . 0.0 111.17 175.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.1 t -57.42 -51.69 68.39 Favored 'General case' 0 C--O 1.22 -0.483 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 172.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.3 t -58.87 -48.3 81.87 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 124.417 1.087 . . . . 0.0 111.879 -172.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.78 -1.23 6.61 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.243 -0.89 . . . . 0.0 112.781 -177.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.511 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 20.1 tt0 -80.98 -10.96 59.65 Favored 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 124.208 1.003 . . . . 0.0 110.893 175.372 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.511 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 83.6 m-85 -135.07 157.88 76.0 Favored Pre-proline 0 N--CA 1.445 -0.715 0 C-N-CA 125.304 1.442 . . . . 0.0 110.807 -168.578 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -67.57 105.75 1.14 Allowed 'Trans proline' 0 N--CA 1.455 -0.783 0 N-CA-C 104.671 -2.857 . . . . 0.0 104.671 166.324 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 22.5 pttp -39.14 -38.74 0.51 Allowed 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 117.895 2.554 . . . . 0.0 117.895 -164.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.02 -15.09 19.69 Favored Glycine 0 CA--C 1.536 1.379 0 CA-C-N 119.365 0.984 . . . . 0.0 114.04 175.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.408 ' HE ' ' HD3' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -57.5 -27.44 62.54 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 126.281 1.833 . . . . 0.0 112.853 170.06 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.8 t -134.95 137.44 43.1 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-O 122.663 1.22 . . . . 0.0 110.865 -173.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 21.6 t -70.66 -55.9 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 CA-C-N 113.904 -1.498 . . . . 0.0 108.797 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 9.7 m -58.44 -43.02 85.77 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 CA-C-O 119.203 -0.427 . . . . 0.0 110.004 -178.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 11.4 t -64.67 -35.67 81.78 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.764 1.625 . . . . 0.0 110.1 179.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 52.5 m -66.02 -25.5 67.09 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 118.959 -0.543 . . . . 0.0 110.921 172.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.42 -40.32 54.92 Favored Glycine 0 C--N 1.344 0.987 0 CA-C-O 123.935 1.853 . . . . 0.0 110.719 167.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -69.45 -40.5 77.14 Favored 'General case' 0 N--CA 1.421 -1.924 0 C-N-CA 126.136 1.774 . . . . 0.0 115.564 -166.319 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 . . . . . 0 C--N 1.32 -0.693 0 CA-C-O 118.704 -0.665 . . . . 0.0 111.507 174.501 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.9 t0 . . . . . 0 CA--C 1.536 0.406 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -57.19 -31.06 89.46 Favored 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 124.039 3.159 . . . . 0.0 112.901 -175.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 54.7 m -94.27 -10.47 32.76 Favored 'General case' 0 N--CA 1.437 -1.108 0 C-N-CA 125.362 1.465 . . . . 0.0 113.052 -169.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 27.7 tp60 -63.21 -24.54 67.92 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 118.447 0.567 . . . . 0.0 111.256 -179.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.6 tppt? -60.48 -53.76 53.65 Favored 'General case' 0 C--N 1.339 0.132 0 C-N-CA 122.991 0.517 . . . . 0.0 109.97 169.276 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -62.49 -39.66 94.2 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.551 0.741 . . . . 0.0 110.004 -177.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -53.97 -45.9 71.52 Favored 'General case' 0 C--N 1.343 0.308 0 C-N-CA 125.044 1.338 . . . . 0.0 112.34 169.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 67.6 m -57.92 -42.76 85.47 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 121.333 -0.147 . . . . 0.0 110.786 174.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -65.04 -22.7 67.02 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-O 117.604 -1.189 . . . . 0.0 112.706 178.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 27.8 mm -59.41 -52.83 56.25 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.244 0 CA-C-N 120.515 1.507 . . . . 0.0 108.962 172.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 33.7 mm-40 -58.34 -53.97 52.24 Favored 'General case' 0 N--CA 1.442 -0.828 0 O-C-N 123.989 0.806 . . . . 0.0 109.051 178.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 57.1 mmtt -68.17 -30.93 70.15 Favored 'General case' 0 N--CA 1.457 -0.078 0 C-N-CA 118.507 -1.277 . . . . 0.0 111.555 -173.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 19.4 t -56.85 -48.73 77.41 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 168.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.93 -46.73 84.59 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 123.203 0.601 . . . . 0.0 110.53 179.353 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -57.16 -45.78 83.32 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.751 0.821 . . . . 0.0 111.231 174.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.98 -12.47 55.22 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 175.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -124.38 8.56 8.43 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.695 1.198 . . . . 0.0 112.387 -172.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 58.49 40.1 24.3 Favored 'General case' 0 C--N 1.345 0.393 0 CA-C-O 122.418 1.104 . . . . 0.0 110.913 179.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.259 7.0 m-85 71.88 13.7 6.02 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 127.826 2.45 . . . . 0.0 114.692 168.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 66.0 mtm -69.98 85.59 0.52 Allowed 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 125.051 1.34 . . . . 0.0 109.791 170.115 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -54.04 -24.93 18.89 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.283 0.633 . . . . 0.0 111.504 171.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.2 m -52.63 -40.33 62.66 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 126.293 1.837 . . . . 0.0 112.297 170.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.1 mmtm -71.79 -46.42 58.37 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.212 1.005 . . . . 0.0 108.794 174.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.7 m -74.67 5.29 5.03 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 124.749 1.219 . . . . 0.0 113.222 -173.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 -57.66 -26.8 62.18 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 119.196 0.907 . . . . 0.0 110.674 166.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.55 -55.7 31.18 Favored 'General case' 0 C--N 1.346 0.446 0 C-N-CA 126.21 1.804 . . . . 0.0 111.709 171.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.6 p -76.07 -27.02 17.75 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.69 0 C-N-CA 123.693 0.797 . . . . 0.0 109.759 -175.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 26.4 mt -62.41 -45.9 97.68 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 168.086 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -52.13 -36.9 52.65 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 118.755 0.707 . . . . 0.0 111.265 171.698 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -71.55 -43.38 66.49 Favored 'General case' 0 N--CA 1.433 -1.311 0 CA-C-O 118.633 -0.699 . . . . 0.0 111.678 178.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.3 mt -63.37 -31.73 72.96 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 119.637 1.108 . . . . 0.0 110.668 173.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.67 -58.47 8.32 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.495 1.118 . . . . 0.0 108.783 177.363 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 55.9 mtpt -62.32 -35.64 79.7 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 113.862 -1.517 . . . . 0.0 111.143 -178.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 41.8 t -60.9 -51.83 67.6 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 170.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 51.5 t -62.79 -49.16 76.08 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 123.406 0.682 . . . . 0.0 111.647 -170.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.05 -1.39 5.79 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.111 -0.95 . . . . 0.0 112.551 -177.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.402 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 2.2 tp-100 -84.5 -7.18 59.36 Favored 'General case' 0 N--CA 1.435 -1.194 0 C-N-CA 124.735 1.214 . . . . 0.0 111.476 177.298 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.402 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 72.9 m-85 -139.67 160.72 60.09 Favored Pre-proline 0 N--CA 1.446 -0.644 0 C-N-CA 124.705 1.202 . . . . 0.0 111.23 -169.43 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -67.29 120.14 7.19 Favored 'Trans proline' 0 N--CA 1.455 -0.788 0 N-CA-C 105.36 -2.592 . . . . 0.0 105.36 165.295 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -47.73 -32.11 5.49 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 116.086 1.884 . . . . 0.0 116.086 -167.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.33 -15.12 36.88 Favored Glycine 0 CA--C 1.536 1.364 0 CA-C-N 118.782 0.719 . . . . 0.0 113.769 176.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.89 -11.41 46.76 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 126.055 1.742 . . . . 0.0 112.419 170.058 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.0 t -153.74 136.75 15.49 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-O 123.104 1.43 . . . . 0.0 113.058 -178.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.0 t -70.52 -53.51 22.28 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 CA-C-N 113.463 -1.699 . . . . 0.0 108.798 176.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.9 m -59.73 -41.69 86.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-O 119.264 -0.398 . . . . 0.0 110.029 -178.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 10.7 t -64.42 -37.45 87.57 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.51 1.524 . . . . 0.0 110.16 177.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 48.8 m -66.17 -23.58 66.49 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 118.949 -0.548 . . . . 0.0 111.264 173.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -77.01 -25.85 63.44 Favored Glycine 0 C--N 1.346 1.089 0 CA-C-O 123.194 1.441 . . . . 0.0 111.781 168.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -81.67 -41.67 21.05 Favored 'General case' 0 N--CA 1.428 -1.538 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 -166.114 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 . . . . . 0 C--N 1.323 -0.586 0 CA-C-O 119.174 -0.441 . . . . 0.0 110.647 171.334 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 44.7 t0 . . . . . 0 CA--C 1.541 0.599 0 CA-C-O 118.314 -0.85 . . . . 0.0 110.993 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -55.08 -31.93 77.26 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 124.177 3.251 . . . . 0.0 113.228 -178.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 84.4 m -96.77 -11.01 25.54 Favored 'General case' 0 N--CA 1.438 -1.073 0 C-N-CA 126.013 1.725 . . . . 0.0 113.6 -169.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.1 tp60 -64.12 -26.03 68.36 Favored 'General case' 0 N--CA 1.444 -0.775 0 CA-C-N 118.294 0.497 . . . . 0.0 110.721 -179.158 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.6 tptt -59.91 -56.11 25.84 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.537 0.735 . . . . 0.0 109.811 169.395 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -60.72 -39.7 89.58 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.117 0.567 . . . . 0.0 109.932 -177.192 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.43 -41.81 85.89 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.991 1.316 . . . . 0.0 112.451 171.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 98.3 m -59.71 -44.13 93.82 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.673 0.67 . . . . 0.0 110.627 171.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -64.97 -20.11 66.32 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 117.69 -1.148 . . . . 0.0 112.44 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 29.6 mm -59.04 -54.09 38.93 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 CA-C-N 120.538 1.517 . . . . 0.0 109.186 170.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 6.7 mm-40 -60.49 -53.38 58.27 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 -178.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 24.6 mttm -68.0 -30.29 69.51 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 118.222 -0.894 . . . . 0.0 111.583 -173.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 15.7 t -58.28 -47.73 82.69 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 119.386 0.994 . . . . 0.0 108.52 168.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.69 -46.83 83.8 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 118.843 -0.599 . . . . 0.0 110.282 178.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -57.55 -44.63 85.34 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.558 0.743 . . . . 0.0 111.419 173.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.85 -13.23 61.38 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 175.143 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 -123.67 8.22 8.86 Favored 'General case' 0 C--N 1.343 0.301 0 C-N-CA 124.725 1.21 . . . . 0.0 112.277 -172.365 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.3 m 58.84 40.14 23.16 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 122.37 1.081 . . . . 0.0 110.774 179.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.26 7.1 m-85 72.02 13.93 5.83 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 127.816 2.446 . . . . 0.0 114.563 168.681 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 68.1 mtm -70.77 83.27 0.64 Allowed 'General case' 0 N--CA 1.441 -0.881 0 C-N-CA 125.293 1.437 . . . . 0.0 109.777 170.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -54.41 -23.57 16.37 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.914 0.886 . . . . 0.0 111.79 172.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 4.3 m -51.98 -42.82 63.24 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 126.096 1.758 . . . . 0.0 111.907 169.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 48.4 mmtt -69.54 -48.02 61.79 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 124.559 1.144 . . . . 0.0 108.891 175.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.0 m -72.27 1.27 7.99 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 124.584 1.154 . . . . 0.0 113.307 -173.615 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 86.7 mm-40 -55.94 -26.77 49.35 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.477 1.035 . . . . 0.0 111.139 166.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.47 -57.9 10.91 Favored 'General case' 0 C--N 1.347 0.466 0 C-N-CA 125.5 1.52 . . . . 0.0 111.677 171.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 14.0 p -74.82 -29.47 22.8 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.76 0 C-N-CA 123.68 0.792 . . . . 0.0 110.145 -173.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 63.8 mt -58.77 -50.83 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.649 0 N-CA-C 105.402 -2.073 . . . . 0.0 105.402 167.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.28 -35.48 67.53 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 119.232 0.923 . . . . 0.0 112.869 175.077 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -68.31 -35.31 77.63 Favored 'General case' 0 N--CA 1.438 -1.05 0 C-N-CA 118.995 -1.082 . . . . 0.0 110.027 179.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.475 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -65.79 -26.33 67.65 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 125.155 1.382 . . . . 0.0 109.885 173.311 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 20.0 mmt85 -71.28 -50.92 27.72 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 177.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 67.2 mmtt -65.87 -25.08 67.02 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.247 179.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 47.6 t -70.36 -55.17 9.77 Favored 'General case' 0 N--CA 1.441 -0.922 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 167.257 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.3 t -60.27 -46.93 88.1 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 121.234 -0.916 . . . . 0.0 112.656 -170.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.12 2.05 6.48 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -175.188 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.54 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 11.6 tt0 -90.36 -8.99 49.34 Favored 'General case' 0 N--CA 1.442 -0.837 0 C-N-CA 126.123 1.769 . . . . 0.0 111.234 -175.681 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.54 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 74.9 m-85 -139.45 160.61 61.01 Favored Pre-proline 0 N--CA 1.445 -0.706 0 C-N-CA 124.637 1.175 . . . . 0.0 111.978 -167.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -66.12 127.97 18.64 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 N-CA-C 105.574 -2.51 . . . . 0.0 105.574 165.065 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -53.24 -32.26 47.46 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 114.271 1.211 . . . . 0.0 114.271 -166.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.82 -9.13 18.37 Favored Glycine 0 CA--C 1.535 1.343 0 C-N-CA 124.566 1.079 . . . . 0.0 114.236 175.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.3 tpm_? -68.44 -17.37 64.19 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 126.172 1.789 . . . . 0.0 112.406 169.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.9 t -149.97 137.95 20.25 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 122.641 1.21 . . . . 0.0 113.306 -170.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 26.2 t -70.11 -56.35 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 113.536 -1.665 . . . . 0.0 108.726 172.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 12.5 m -62.87 -41.72 93.71 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 CA-C-O 118.637 -0.696 . . . . 0.0 110.397 -172.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 28.0 t -63.06 -33.81 76.23 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.244 1.418 . . . . 0.0 110.118 176.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 56.9 m -67.92 -21.09 65.13 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 118.549 -0.739 . . . . 0.0 111.363 172.413 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -75.38 -39.95 34.56 Favored Glycine 0 C--N 1.344 1.004 0 CA-C-O 124.202 2.001 . . . . 0.0 110.796 166.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.475 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 1.2 t80 -73.92 -40.55 63.05 Favored 'General case' 0 N--CA 1.417 -2.097 0 CA-C-N 112.016 -2.092 . . . . 0.0 116.546 -163.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 . . . . . 0 C--N 1.321 -0.642 0 C-N-CA 119.86 -0.736 . . . . 0.0 110.937 170.652 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 24.6 t0 . . . . . 0 N--CA 1.439 -0.979 0 N-CA-C 104.437 -2.431 . . . . 0.0 104.437 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -56.21 -30.04 78.2 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 123.91 3.073 . . . . 0.0 112.702 -169.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 69.7 m -94.25 -10.89 31.47 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.56 1.544 . . . . 0.0 112.772 -171.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 22.2 tp60 -63.94 -25.09 67.98 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 118.618 0.645 . . . . 0.0 111.045 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 46.3 tttm -59.76 -55.9 28.5 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.624 1.17 . . . . 0.0 110.024 168.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 -65.25 -33.76 76.76 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.016 0.527 . . . . 0.0 110.072 -178.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -62.52 -40.27 96.24 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.535 0.734 . . . . 0.0 112.102 172.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 74.2 m -59.03 -44.97 91.81 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.411 0.55 . . . . 0.0 110.017 171.045 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -60.05 -28.1 67.49 Favored 'General case' 0 C--O 1.226 -0.133 0 CA-C-O 117.739 -1.124 . . . . 0.0 112.037 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 43.8 mm -57.76 -55.29 22.42 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.248 0 CA-C-N 120.013 1.279 . . . . 0.0 109.703 173.052 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -57.83 -55.15 38.61 Favored 'General case' 0 N--CA 1.444 -0.725 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 -178.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.6 mptp? -66.98 -31.99 72.92 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 118.824 -1.151 . . . . 0.0 111.789 -174.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 21.2 t -56.14 -48.46 76.21 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 119.532 1.06 . . . . 0.0 108.746 169.191 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.62 -47.02 85.76 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 123.208 0.603 . . . . 0.0 110.5 179.565 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -57.04 -45.79 82.9 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.608 0.763 . . . . 0.0 111.197 174.367 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.71 -13.12 58.65 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.128 0.971 . . . . 0.0 113.406 175.627 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 -123.66 8.89 8.89 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 124.579 1.152 . . . . 0.0 112.197 -173.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 57.91 40.31 25.91 Favored 'General case' 0 C--N 1.345 0.41 0 CA-C-O 122.437 1.113 . . . . 0.0 110.989 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.262 6.8 m-85 72.34 13.93 5.5 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 127.803 2.441 . . . . 0.0 114.445 168.848 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 68.5 mtm -70.67 84.51 0.63 Allowed 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 125.118 1.367 . . . . 0.0 109.866 170.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -53.89 -24.01 14.62 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.892 0.877 . . . . 0.0 111.679 171.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.7 m -53.37 -40.37 64.94 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.028 1.731 . . . . 0.0 112.304 170.462 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 51.8 mmtt -71.92 -47.48 52.27 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.375 1.07 . . . . 0.0 108.778 174.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 71.6 m -72.53 1.89 7.33 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.771 1.229 . . . . 0.0 113.356 -174.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 74.7 mm-40 -54.76 -27.54 41.92 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 119.587 1.085 . . . . 0.0 110.911 167.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.47 -57.63 12.14 Favored 'General case' 0 C--N 1.347 0.467 0 C-N-CA 126.011 1.724 . . . . 0.0 111.961 172.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.0 p -74.41 -29.73 24.71 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.722 0 C-N-CA 123.712 0.805 . . . . 0.0 109.7 -174.333 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 72.5 mt -61.74 -45.33 98.92 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 169.207 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.64 -38.73 69.93 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 118.702 0.683 . . . . 0.0 111.914 172.551 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -70.93 -40.22 72.21 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 118.482 -1.287 . . . . 0.0 109.966 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.408 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -66.13 -26.78 67.6 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.877 0.871 . . . . 0.0 109.786 178.026 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.71 -56.03 12.42 Favored 'General case' 0 CA--C 1.513 -0.443 0 C-N-CA 125.193 1.397 . . . . 0.0 108.578 176.38 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 7.9 mptt -61.01 -32.53 72.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 113.519 -1.673 . . . . 0.0 110.436 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 47.4 t -63.94 -55.97 18.61 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 168.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 52.8 t -58.89 -46.54 87.62 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 124.007 0.923 . . . . 0.0 112.457 -170.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.87 -3.01 13.9 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.249 -0.887 . . . . 0.0 112.833 -177.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.423 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 3.1 tp-100 -86.46 -5.74 59.08 Favored 'General case' 0 N--CA 1.438 -1.052 0 C-N-CA 124.57 1.148 . . . . 0.0 111.71 -177.346 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.423 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 79.5 m-85 -138.2 159.78 66.77 Favored Pre-proline 0 N--CA 1.444 -0.747 0 C-N-CA 124.531 1.132 . . . . 0.0 111.261 -168.652 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -66.97 113.11 2.68 Favored 'Trans proline' 0 N--CA 1.454 -0.845 0 N-CA-C 105.159 -2.67 . . . . 0.0 105.159 165.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 39.6 mmtm -42.75 -35.62 1.2 Allowed 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 116.306 1.965 . . . . 0.0 116.306 -166.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.68 -15.86 20.56 Favored Glycine 0 CA--C 1.539 1.548 0 C-N-CA 124.629 1.109 . . . . 0.0 114.266 175.188 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.2 tpm_? -58.51 -24.22 59.99 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.745 2.018 . . . . 0.0 111.835 169.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 8.1 t -145.2 130.72 18.81 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-O 123.359 1.552 . . . . 0.0 112.787 -169.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.4 t -68.74 -50.71 52.62 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 CA-C-N 112.681 -2.054 . . . . 0.0 108.566 176.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.9 m -61.0 -45.37 98.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 CA-C-O 118.555 -0.735 . . . . 0.0 109.592 -178.191 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 24.4 t -61.65 -35.14 77.1 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.299 1.84 . . . . 0.0 110.304 178.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.6 m -66.96 -26.34 66.78 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.188 0.595 . . . . 0.0 111.303 172.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.84 -30.87 60.9 Favored Glycine 0 C--N 1.344 1.01 0 CA-C-O 123.437 1.576 . . . . 0.0 111.731 168.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.408 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.6 OUTLIER -81.36 -41.16 22.41 Favored 'General case' 0 N--CA 1.424 -1.733 0 N-CA-C 117.39 2.367 . . . . 0.0 117.39 -164.393 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 . . . . . 0 C--N 1.322 -0.623 0 CA-C-O 118.9 -0.571 . . . . 0.0 109.565 168.717 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.6 t0 . . . . . 0 CA--C 1.538 0.481 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -60.27 -32.9 94.86 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 123.747 2.965 . . . . 0.0 112.802 -171.208 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 96.3 m -94.14 -12.19 28.9 Favored 'General case' 0 N--CA 1.437 -1.099 0 C-N-CA 124.475 1.11 . . . . 0.0 113.144 -168.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 18.8 tp60 -61.38 -26.79 68.07 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 122.756 0.422 . . . . 0.0 110.833 177.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 51.9 tptt -60.05 -57.7 11.69 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.451 0.7 . . . . 0.0 109.807 168.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -60.28 -37.52 80.73 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 122.983 0.513 . . . . 0.0 110.317 -176.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -60.43 -35.82 76.73 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.465 1.106 . . . . 0.0 113.037 172.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 75.8 m -64.07 -44.49 92.23 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 118.343 0.52 . . . . 0.0 110.396 169.351 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.4 mm-40 -64.1 -25.09 67.95 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 117.955 -1.022 . . . . 0.0 112.28 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 46.8 mm -56.44 -50.5 72.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.243 0 CA-C-N 119.964 1.256 . . . . 0.0 109.409 169.251 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 -60.78 -55.39 33.74 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 -175.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 48.1 mttt -69.94 -30.58 68.0 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 118.245 -0.884 . . . . 0.0 111.425 -172.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 17.3 t -57.14 -46.76 82.42 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 168.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.05 -45.95 89.48 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 118.49 -0.767 . . . . 0.0 110.354 179.025 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -58.28 -45.27 88.21 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 119.177 0.899 . . . . 0.0 111.282 174.235 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.07 -13.53 58.21 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.048 0.939 . . . . 0.0 113.306 175.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -124.38 9.04 8.46 Favored 'General case' 0 C--N 1.343 0.289 0 C-N-CA 124.425 1.09 . . . . 0.0 112.351 -172.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.6 m 57.83 40.45 26.04 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 122.464 1.126 . . . . 0.0 110.814 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.256 6.8 m-85 72.01 13.98 5.84 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 127.852 2.461 . . . . 0.0 114.44 168.781 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 66.1 mtm -70.23 85.6 0.57 Allowed 'General case' 0 N--CA 1.44 -0.931 0 C-N-CA 125.132 1.373 . . . . 0.0 109.723 169.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -53.37 -25.69 16.45 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.312 0.645 . . . . 0.0 111.381 170.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.1 m -52.31 -38.86 59.62 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 126.744 2.018 . . . . 0.0 112.675 170.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.7 mmtm -74.17 -47.51 35.33 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.369 1.068 . . . . 0.0 108.69 173.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.2 m -71.71 0.89 7.72 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 124.892 1.277 . . . . 0.0 113.281 -174.496 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 51.6 mm-40 -54.72 -28.26 46.8 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 119.652 1.114 . . . . 0.0 110.242 166.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.59 -56.65 19.44 Favored 'General case' 0 C--N 1.346 0.441 0 C-N-CA 125.789 1.636 . . . . 0.0 111.906 171.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 13.4 p -75.77 -28.34 19.31 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.835 0 C-N-CA 123.288 0.635 . . . . 0.0 110.002 -174.113 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 60.0 mt -61.91 -45.85 97.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 N-CA-C 106.564 -1.643 . . . . 0.0 106.564 168.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.92 -38.41 70.24 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 119.202 0.91 . . . . 0.0 112.284 171.129 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -70.26 -37.85 74.98 Favored 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 119.354 -0.938 . . . . 0.0 110.085 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.413 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -65.28 -30.81 71.71 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 124.673 1.189 . . . . 0.0 108.834 174.957 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.0 mmt-85 -69.96 -49.89 47.31 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -61.02 -35.43 76.85 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-N 114.895 -1.048 . . . . 0.0 110.698 177.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 51.0 t -61.81 -57.17 12.89 Favored 'General case' 0 C--O 1.219 -0.551 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 168.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 35.4 t -58.39 -44.29 88.89 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 123.856 0.862 . . . . 0.0 112.144 -169.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.41 -1.21 10.01 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 124.03 0.932 . . . . 0.0 113.296 -178.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.526 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 15.5 tt0 -83.87 -8.85 59.1 Favored 'General case' 0 N--CA 1.444 -0.764 0 C-N-CA 124.435 1.094 . . . . 0.0 111.105 176.902 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.526 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 90.6 m-85 -138.97 158.02 70.49 Favored Pre-proline 0 N--CA 1.441 -0.894 0 C-N-CA 124.979 1.312 . . . . 0.0 112.106 -166.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -69.86 111.06 2.73 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 N-CA-C 104.968 -2.743 . . . . 0.0 104.968 165.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 64.3 pttt -42.01 -32.57 0.46 Allowed 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 117.964 2.579 . . . . 0.0 117.964 -166.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -56.47 -15.76 12.95 Favored Glycine 0 CA--C 1.538 1.509 0 CA-C-N 119.468 1.031 . . . . 0.0 114.177 172.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 5.0 tpm_? -54.05 -24.74 18.31 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 127.583 2.353 . . . . 0.0 112.132 168.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.3 t -146.76 137.74 24.05 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-O 122.73 1.252 . . . . 0.0 111.82 -170.392 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 18.7 t -66.84 -53.71 31.98 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.677 0 CA-C-N 113.491 -1.686 . . . . 0.0 108.487 177.172 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 3.8 m -60.26 -46.08 95.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-O 118.47 -0.776 . . . . 0.0 109.415 -178.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 41.9 t -63.31 -30.22 71.39 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.125 1.37 . . . . 0.0 109.943 -178.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 52.3 m -68.45 -27.48 66.21 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.186 0.595 . . . . 0.0 111.277 172.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -71.08 -40.42 61.98 Favored Glycine 0 N--CA 1.473 1.113 0 CA-C-O 124.781 2.323 . . . . 0.0 110.752 167.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.413 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 2.0 t80 -77.54 -35.88 52.87 Favored 'General case' 0 N--CA 1.41 -2.468 0 CA-C-N 111.22 -2.49 . . . . 0.0 116.677 -163.214 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 . . . . . 0 C--N 1.32 -0.711 0 CA-C-O 118.258 -0.877 . . . . 0.0 110.909 169.363 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.0 t0 . . . . . 0 CA--C 1.541 0.619 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_exo -54.97 -30.59 70.1 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 125.175 3.916 . . . . 0.0 113.639 -172.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 91.6 m -97.74 -11.87 22.93 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 125.83 1.652 . . . . 0.0 113.261 -169.026 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 23.1 tp60 -62.52 -26.83 68.76 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 118.194 0.452 . . . . 0.0 110.722 -178.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 51.5 tttm -58.4 -56.09 26.65 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 123.605 0.762 . . . . 0.0 110.497 169.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -62.73 -44.53 95.97 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.3 0.64 . . . . 0.0 109.667 -176.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -52.98 -38.76 62.49 Favored 'General case' 0 N--CA 1.462 0.171 0 C-N-CA 125.056 1.343 . . . . 0.0 113.218 173.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 66.4 m -60.03 -44.09 94.86 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 120.162 -0.615 . . . . 0.0 110.333 172.252 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -66.75 -27.59 67.73 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 117.324 -1.322 . . . . 0.0 113.196 -179.276 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.8 mp -55.88 -48.82 77.87 Favored 'Isoleucine or valine' 0 C--N 1.343 0.294 0 CA-C-N 121.037 1.744 . . . . 0.0 109.598 169.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -59.91 -55.98 27.41 Favored 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 24.3 mmtm -68.86 -31.56 70.61 Favored 'General case' 0 CA--C 1.522 -0.098 0 CA-C-O 118.527 -0.749 . . . . 0.0 112.004 -171.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 27.6 t -55.04 -47.01 75.34 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 169.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.54 -45.44 91.78 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-O 118.435 -0.793 . . . . 0.0 110.463 179.248 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -57.97 -46.56 84.95 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 119.261 0.937 . . . . 0.0 111.007 174.24 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.62 -14.86 59.86 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.044 0.937 . . . . 0.0 113.365 176.335 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 -120.8 8.34 10.55 Favored 'General case' 0 C--N 1.343 0.298 0 C-N-CA 124.334 1.054 . . . . 0.0 112.056 -174.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.5 m 57.56 40.75 26.64 Favored 'General case' 0 C--N 1.345 0.406 0 CA-C-O 122.511 1.148 . . . . 0.0 110.78 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.269 6.9 m-85 72.59 14.39 5.17 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 128.045 2.538 . . . . 0.0 114.48 168.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 69.5 mtm -70.08 82.39 0.5 Allowed 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 125.13 1.372 . . . . 0.0 109.941 169.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -52.97 -24.44 9.4 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.637 1.175 . . . . 0.0 111.164 169.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.0 m -51.4 -44.12 62.12 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 126.107 1.763 . . . . 0.0 112.201 169.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.3 mmtt -73.11 -47.77 41.44 Favored 'General case' 0 C--O 1.232 0.182 0 C-N-CA 124.634 1.174 . . . . 0.0 108.963 176.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.0 m -69.51 0.61 5.01 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 124.648 1.179 . . . . 0.0 113.073 -176.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 52.4 mm-40 -54.9 -30.27 57.91 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 119.887 1.221 . . . . 0.0 110.8 166.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.01 -54.79 43.12 Favored 'General case' 0 C--N 1.344 0.367 0 C-N-CA 124.702 1.201 . . . . 0.0 111.463 173.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.0 p -75.56 -31.02 22.63 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.727 0 C-N-CA 122.871 0.468 . . . . 0.0 110.405 -174.403 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 69.1 mt -59.03 -46.32 91.79 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 N-CA-C 106.345 -1.724 . . . . 0.0 106.345 168.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.71 -26.48 61.82 Favored 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 121.011 -1.056 . . . . 0.0 113.281 173.706 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -76.49 -37.76 56.32 Favored 'General case' 0 N--CA 1.432 -1.356 0 C-N-CA 119.846 -0.742 . . . . 0.0 110.277 175.16 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.402 ' HB3' ' CE2' ' A' ' 53' ' ' PHE . 2.8 mt -62.6 -32.37 73.36 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-O 117.778 -1.106 . . . . 0.0 109.514 169.5 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.5 mmt180 -62.79 -53.8 48.75 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 120.163 1.347 . . . . 0.0 108.195 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 54.6 mttp -64.2 -34.44 78.1 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.177 -178.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 47.5 t -63.25 -51.57 65.63 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 110.105 -0.332 . . . . 0.0 110.105 169.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 45.5 t -65.05 -47.77 76.2 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 124.673 1.189 . . . . 0.0 111.84 -169.065 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.93 -1.02 6.35 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 115.551 -0.75 . . . . 0.0 112.331 -175.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.533 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 12.0 tt0 -80.28 -11.66 59.7 Favored 'General case' 0 N--CA 1.443 -0.821 0 C-N-CA 125.94 1.696 . . . . 0.0 110.999 176.643 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.533 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 84.9 m-85 -136.42 158.03 74.21 Favored Pre-proline 0 N--CA 1.439 -0.99 0 C-N-CA 125.449 1.499 . . . . 0.0 111.243 -167.814 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -68.25 109.0 1.89 Allowed 'Trans proline' 0 N--CA 1.455 -0.771 0 N-CA-C 104.295 -3.002 . . . . 0.0 104.295 165.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.51 -36.49 0.39 Allowed 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 117.739 2.496 . . . . 0.0 117.739 -165.668 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.2 -14.72 12.42 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 124.55 1.071 . . . . 0.0 114.234 174.531 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 35.6 tpt85 -51.99 -33.2 37.12 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 126.986 2.114 . . . . 0.0 111.542 168.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.2 t -136.92 139.53 41.63 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-O 122.428 1.109 . . . . 0.0 110.625 -168.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 15.3 t -68.15 -54.08 24.71 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.695 0 CA-C-N 114.016 -1.447 . . . . 0.0 108.362 177.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 6.8 m -62.48 -42.42 95.67 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.119 -176.267 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 36.7 t -64.06 -32.37 73.89 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.634 1.574 . . . . 0.0 110.284 177.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.0 m -69.57 -26.04 64.28 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.83 -0.544 . . . . 0.0 111.131 171.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.91 -32.05 66.64 Favored Glycine 0 C--N 1.344 0.985 0 CA-C-O 123.427 1.571 . . . . 0.0 111.266 167.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.402 ' CE2' ' HB3' ' A' ' 35' ' ' LEU . 1.2 t80 -80.57 -43.23 20.97 Favored 'General case' 0 N--CA 1.417 -2.097 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 -164.206 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 25.6 mm-40 . . . . . 0 CA--C 1.542 0.637 0 C-N-CA 119.634 -0.826 . . . . 0.0 110.4 171.17 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 20.5 t0 . . . . . 0 N--CA 1.447 -0.588 0 N-CA-C 105.941 -1.874 . . . . 0.0 105.941 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -54.7 -34.75 85.13 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 124.497 3.465 . . . . 0.0 112.664 -170.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 77.5 m -94.48 -13.77 25.82 Favored 'General case' 0 N--CA 1.433 -1.319 0 C-N-CA 125.54 1.536 . . . . 0.0 113.03 -169.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 26.2 tp60 -61.85 -25.28 67.43 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 118.754 0.707 . . . . 0.0 111.224 -179.136 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 51.8 tttm -59.53 -56.62 19.71 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.766 1.226 . . . . 0.0 110.166 169.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -63.61 -38.23 90.34 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.73 0.812 . . . . 0.0 110.203 -177.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.99 -42.17 72.14 Favored 'General case' 0 C--N 1.339 0.148 0 C-N-CA 124.901 1.28 . . . . 0.0 112.816 171.18 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 82.0 m -57.56 -46.48 83.89 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.29 172.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -62.99 -25.44 68.38 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 117.84 -1.076 . . . . 0.0 112.253 -178.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 34.6 mm -57.15 -54.47 29.98 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.378 0 CA-C-N 120.019 1.281 . . . . 0.0 109.235 172.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 36.7 mm-40 -58.18 -54.47 46.65 Favored 'General case' 0 N--CA 1.443 -0.816 0 O-C-N 124.18 0.925 . . . . 0.0 108.934 -178.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -66.5 -32.68 74.18 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 118.925 -1.11 . . . . 0.0 111.693 -175.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 25.2 t -56.2 -48.89 75.53 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 119.443 1.02 . . . . 0.0 108.902 169.397 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.73 -46.8 86.55 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 123.244 0.618 . . . . 0.0 110.487 179.826 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -57.11 -45.92 83.04 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.977 0.911 . . . . 0.0 111.199 174.35 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.54 -12.4 52.5 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.18 0.992 . . . . 0.0 113.424 175.3 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 52.2 m-80 -124.67 8.83 8.27 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.688 1.195 . . . . 0.0 112.187 -173.13 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.1 m 57.93 40.31 25.85 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.646 1.112 . . . . 0.0 110.979 179.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.265 6.9 m-85 72.17 14.05 5.66 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 127.817 2.447 . . . . 0.0 114.619 168.846 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 64.5 mtm -69.47 86.52 0.44 Allowed 'General case' 0 N--CA 1.44 -0.964 0 C-N-CA 125.127 1.371 . . . . 0.0 109.962 169.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -53.5 -26.12 19.42 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.252 1.021 . . . . 0.0 111.21 169.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.5 m -57.05 -32.13 65.89 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 127.497 2.319 . . . . 0.0 113.514 170.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.5 mmtm -79.62 -45.55 18.89 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.251 1.02 . . . . 0.0 108.769 171.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 81.2 m -73.88 9.0 1.67 Allowed 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 125.675 1.59 . . . . 0.0 113.709 -175.117 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 59.9 mm-40 -53.16 -38.14 62.48 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.425 -0.797 . . . . 0.0 110.737 168.049 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.31 -50.11 74.94 Favored 'General case' 0 C--N 1.342 0.242 0 C-N-CA 123.666 0.786 . . . . 0.0 111.631 178.21 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.7 p -75.13 -28.4 20.68 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.841 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.741 -175.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 55.4 mt -61.19 -50.14 81.72 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.637 0 N-CA-C 106.852 -1.536 . . . . 0.0 106.852 169.003 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -55.23 -27.81 48.83 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 123.819 0.848 . . . . 0.0 111.139 176.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -74.66 -43.29 56.02 Favored 'General case' 0 N--CA 1.441 -0.91 0 O-C-N 121.75 -0.594 . . . . 0.0 112.421 174.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.6 mt -62.14 -30.38 71.0 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 119.393 0.997 . . . . 0.0 110.547 170.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.9 ttt-85 -64.78 -58.88 5.04 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 126.433 1.893 . . . . 0.0 110.155 178.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.7 ptmt -65.94 -27.98 68.57 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.796 -179.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 47.7 t -65.76 -51.44 59.16 Favored 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 168.422 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.1 t -62.9 -48.78 77.49 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.435 0.694 . . . . 0.0 112.186 -169.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.48 -2.81 5.07 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 124.176 0.99 . . . . 0.0 112.608 -176.39 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.534 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 14.2 tt0 -79.26 -12.15 59.95 Favored 'General case' 0 N--CA 1.441 -0.883 0 C-N-CA 125.57 1.548 . . . . 0.0 111.032 175.677 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.534 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 83.9 m-85 -135.31 159.22 72.6 Favored Pre-proline 0 N--CA 1.442 -0.833 0 C-N-CA 125.032 1.333 . . . . 0.0 111.801 -167.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -69.19 115.14 3.87 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 N-CA-C 104.926 -2.759 . . . . 0.0 104.926 165.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.433 ' H ' ' HE2' ' A' ' 44' ' ' LYS . 0.3 OUTLIER -38.6 -44.39 0.97 Allowed 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 116.234 1.939 . . . . 0.0 116.234 -166.417 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -56.89 -12.36 6.87 Favored Glycine 0 CA--C 1.535 1.327 0 C-N-CA 124.842 1.21 . . . . 0.0 114.328 178.105 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 34.8 tpt85 -54.28 -34.24 60.4 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 127.01 2.124 . . . . 0.0 111.91 169.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.5 t -143.23 142.13 31.3 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 122.344 1.068 . . . . 0.0 111.055 -168.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 6.5 t -70.03 -56.39 11.45 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 CA-C-N 114.257 -1.338 . . . . 0.0 108.84 -179.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.2 m -60.23 -37.56 74.06 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 122.927 0.491 . . . . 0.0 110.581 -177.037 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 8.1 t -69.37 -38.29 77.97 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.278 1.031 . . . . 0.0 109.919 177.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 44.5 m -65.04 -27.07 68.55 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.605 -0.685 . . . . 0.0 110.506 171.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.61 -25.61 75.42 Favored Glycine 0 C--N 1.343 0.959 0 CA-C-O 121.455 0.475 . . . . 0.0 112.5 169.66 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -80.69 -46.42 15.58 Favored 'General case' 0 N--CA 1.431 -1.412 0 N-CA-C 115.449 1.648 . . . . 0.0 115.449 -165.489 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 . . . . . 0 N--CA 1.444 -0.733 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.925 173.936 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 18.1 t0 . . . . . 0 N--CA 1.448 -0.551 0 N-CA-C 108.185 -1.042 . . . . 0.0 108.185 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -56.84 -34.48 96.86 Favored 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 123.979 3.119 . . . . 0.0 112.699 -170.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 69.2 m -94.24 -13.06 26.97 Favored 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 125.134 1.374 . . . . 0.0 112.914 -169.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 33.3 tp60 -62.72 -25.81 68.36 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 118.614 0.643 . . . . 0.0 110.827 179.206 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 50.7 tptt -60.11 -54.49 45.3 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 123.336 0.654 . . . . 0.0 110.21 169.238 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -62.98 -38.99 93.38 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.382 0.673 . . . . 0.0 109.907 -177.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -55.35 -45.02 76.48 Favored 'General case' 0 CA--C 1.518 -0.288 0 C-N-CA 124.954 1.302 . . . . 0.0 112.406 169.585 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 62.6 m -59.09 -40.34 85.0 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 118.119 0.418 . . . . 0.0 111.337 173.208 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -65.4 -21.52 66.68 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-O 117.776 -1.107 . . . . 0.0 112.679 176.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 28.0 mm -60.26 -50.37 80.51 Favored 'Isoleucine or valine' 0 C--N 1.342 0.28 0 CA-C-N 120.532 1.514 . . . . 0.0 109.388 171.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -58.75 -57.08 14.58 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 107.409 -1.33 . . . . 0.0 107.409 179.618 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 42.0 mtpt -68.35 -29.43 68.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 118.597 -0.716 . . . . 0.0 111.701 -169.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 25.7 t -56.15 -47.56 77.96 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 118.889 0.768 . . . . 0.0 109.186 169.024 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.41 -44.86 89.22 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 118.662 -0.685 . . . . 0.0 111.086 178.748 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.451 ' HA ' ' CE1' ' A' ' 23' ' ' TYR . 3.0 mp0 -58.37 -43.49 88.48 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 118.214 0.461 . . . . 0.0 111.428 173.665 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.99 -12.44 61.61 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 114.189 1.181 . . . . 0.0 114.189 176.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -125.87 15.01 8.02 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 119.673 1.124 . . . . 0.0 113.789 -168.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 18.1 m 60.56 35.1 20.16 Favored 'General case' 0 C--N 1.346 0.414 0 CA-C-N 120.619 1.554 . . . . 0.0 110.067 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.451 ' CE1' ' HA ' ' A' ' 19' ' ' GLN . 38.0 m-85 68.18 14.83 9.33 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 126.588 1.955 . . . . 0.0 113.737 167.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 62.9 mtm -74.54 89.72 2.2 Favored 'General case' 0 N--CA 1.439 -1.021 0 C-N-CA 126.048 1.739 . . . . 0.0 108.903 175.553 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -55.42 -23.77 26.74 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 119.165 -0.445 . . . . 0.0 111.405 172.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.4 m -52.33 -44.69 65.3 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 126.424 1.89 . . . . 0.0 112.098 170.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 62.8 mmtt -67.32 -47.65 69.9 Favored 'General case' 0 C--N 1.341 0.205 0 C-N-CA 123.832 0.853 . . . . 0.0 108.959 174.044 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 71.8 m -71.31 0.61 7.66 Favored 'General case' 0 N--CA 1.443 -0.791 0 C-N-CA 124.455 1.102 . . . . 0.0 112.945 -174.181 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 -56.59 -25.71 53.48 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 120.042 1.292 . . . . 0.0 111.101 167.186 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.06 -49.43 76.94 Favored 'General case' 0 C--N 1.345 0.381 0 C-N-CA 125.648 1.579 . . . . 0.0 112.174 169.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.4 p -82.67 -26.5 8.45 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.877 0 C-N-CA 123.917 0.887 . . . . 0.0 109.88 -174.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.5 mp -59.39 -47.06 91.95 Favored 'Isoleucine or valine' 0 C--N 1.348 0.541 0 N-CA-C 105.476 -2.046 . . . . 0.0 105.476 165.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.14 -32.53 62.16 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 123.12 0.568 . . . . 0.0 112.002 175.372 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -74.92 -39.88 61.17 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 119.951 -0.7 . . . . 0.0 111.463 178.361 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.6 mt -63.6 -35.48 80.65 Favored 'General case' 0 C--N 1.342 0.248 0 CA-C-N 119.217 0.917 . . . . 0.0 110.097 173.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.07 -60.46 3.46 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 125.104 1.361 . . . . 0.0 109.592 174.357 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -59.95 -38.54 82.77 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 113.728 -1.578 . . . . 0.0 110.235 -176.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 52.3 t -60.44 -52.06 66.84 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 122.937 0.495 . . . . 0.0 109.678 171.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 38.1 t -60.15 -43.36 95.82 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 121.09 0.472 . . . . 0.0 111.323 -172.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.04 -2.03 6.95 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 125.383 1.473 . . . . 0.0 113.378 179.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.525 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 23.3 tt0 -80.46 -8.81 59.69 Favored 'General case' 0 N--CA 1.442 -0.84 0 C-N-CA 123.882 0.873 . . . . 0.0 110.523 171.809 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.525 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 84.6 m-85 -141.07 167.12 18.37 Favored Pre-proline 0 N--CA 1.444 -0.765 0 C-N-CA 125.659 1.584 . . . . 0.0 111.458 -167.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -66.24 139.42 55.03 Favored 'Trans proline' 0 CA--C 1.538 0.698 0 N-CA-C 106.633 -2.103 . . . . 0.0 106.633 164.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.9 ptpp? -57.92 -26.69 62.55 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 115.115 1.524 . . . . 0.0 115.115 -168.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -80.69 0.62 85.66 Favored Glycine 0 CA--C 1.531 1.07 0 C-N-CA 124.24 0.924 . . . . 0.0 113.817 177.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 46.0 tpt85 -58.13 -35.97 72.27 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-N 119.368 1.584 . . . . 0.0 112.623 179.217 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -141.14 151.36 43.83 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 124.832 1.253 . . . . 0.0 110.038 -166.258 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 8.8 t -69.02 -56.68 11.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 123.938 0.895 . . . . 0.0 109.259 -177.37 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 9.2 m -59.73 -38.96 78.34 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 C-N-CA 122.954 0.502 . . . . 0.0 109.982 -179.09 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 11.2 t -68.39 -35.37 77.59 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.349 1.06 . . . . 0.0 109.837 179.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 48.9 m -64.36 -28.15 69.5 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 121.744 -0.598 . . . . 0.0 110.592 172.491 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -74.38 -25.14 71.28 Favored Glycine 0 C--N 1.344 1.012 0 CA-C-O 121.981 0.767 . . . . 0.0 111.809 172.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -81.9 -50.25 9.39 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.944 1.698 . . . . 0.0 114.447 -167.805 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 . . . . . 0 N--CA 1.443 -0.824 0 CA-C-N 115.591 -0.732 . . . . 0.0 110.434 174.18 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.6 t0 . . . . . 0 N--CA 1.448 -0.572 0 N-CA-C 102.92 -2.993 . . . . 0.0 102.92 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -66.79 -35.88 26.03 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 123.555 2.837 . . . . 0.0 112.219 -169.494 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 87.5 m -94.77 -13.65 25.45 Favored 'General case' 0 N--CA 1.436 -1.155 0 C-N-CA 124.006 0.922 . . . . 0.0 113.45 -167.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.9 tm0? -51.21 -37.49 47.05 Favored 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 125.289 1.436 . . . . 0.0 111.489 171.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -57.23 -58.76 6.8 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 125.323 1.449 . . . . 0.0 110.039 171.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -62.39 -36.93 83.85 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.271 0.628 . . . . 0.0 110.774 -176.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -57.95 -38.91 76.84 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.617 1.167 . . . . 0.0 112.172 172.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 75.5 m -61.36 -43.06 99.51 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 118.399 0.545 . . . . 0.0 110.718 172.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -63.79 -22.33 66.86 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 117.95 -1.024 . . . . 0.0 112.328 178.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 23.9 mm -60.51 -53.7 45.28 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.334 0 CA-C-N 120.291 1.405 . . . . 0.0 109.277 171.571 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 16.8 mm-40 -61.35 -52.34 65.05 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 -178.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 40.7 mtpt -68.13 -30.75 69.97 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 118.29 -0.862 . . . . 0.0 111.354 -174.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 14.1 t -58.01 -47.94 81.53 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-N 119.298 0.954 . . . . 0.0 108.444 168.36 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.7 -47.02 83.55 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.287 0.635 . . . . 0.0 110.384 179.068 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -57.46 -44.9 85.19 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.918 0.887 . . . . 0.0 111.193 174.119 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.58 -12.76 59.37 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 175.016 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 47.9 m-80 -124.37 8.63 8.44 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 124.584 1.154 . . . . 0.0 112.308 -172.46 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 58.61 40.11 23.92 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 122.367 1.08 . . . . 0.0 110.915 179.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.258 7.1 m-85 71.98 13.98 5.87 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 127.883 2.473 . . . . 0.0 114.619 168.78 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 68.3 mtm -70.63 83.93 0.62 Allowed 'General case' 0 N--CA 1.443 -0.821 0 C-N-CA 125.128 1.371 . . . . 0.0 109.695 170.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -54.4 -23.26 15.03 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.687 0.795 . . . . 0.0 111.722 172.283 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.6 m -53.03 -40.87 64.21 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 126.013 1.725 . . . . 0.0 112.273 170.047 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 50.6 mmtt -70.81 -47.69 58.13 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 124.31 1.044 . . . . 0.0 108.809 174.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.6 m -73.12 1.37 9.25 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 124.711 1.205 . . . . 0.0 113.267 -173.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 76.0 mm-40 -54.41 -31.08 54.31 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 119.485 1.039 . . . . 0.0 110.488 167.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.69 -58.23 8.69 Favored 'General case' 0 C--N 1.345 0.39 0 C-N-CA 124.884 1.274 . . . . 0.0 111.463 174.096 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.8 p -74.6 -28.99 22.77 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.91 0 C-N-CA 123.981 0.913 . . . . 0.0 109.995 -173.243 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 58.1 mt -59.52 -48.99 85.29 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 N-CA-C 105.943 -1.873 . . . . 0.0 105.943 168.043 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.448 HE22 ' NH1' ' A' ' 36' ' ' ARG . 0.7 OUTLIER -61.1 -31.6 71.28 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 119.325 0.966 . . . . 0.0 113.097 175.572 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -68.49 -39.92 81.14 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 119.433 1.015 . . . . 0.0 110.089 175.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.33 -29.05 70.43 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 124.648 1.179 . . . . 0.0 108.774 176.037 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.448 ' NH1' HE22 ' A' ' 33' ' ' GLN . 10.3 mmt85 -69.68 -50.44 43.85 Favored 'General case' 0 CA--C 1.512 -0.505 0 CA-C-N 119.203 0.91 . . . . 0.0 108.556 -179.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 62.9 mmtt -63.07 -32.84 74.3 Favored 'General case' 0 C--O 1.235 0.296 0 O-C-N 123.849 0.718 . . . . 0.0 111.069 178.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.2 t -62.5 -54.59 37.71 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 169.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 46.5 t -62.88 -47.95 81.11 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 124.058 0.943 . . . . 0.0 111.936 -169.694 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.26 -0.95 5.28 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 124.59 1.156 . . . . 0.0 112.609 -177.467 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.464 ' HB3' ' CE2' ' A' ' 42' ' ' TYR . 2.1 tp-100 -79.13 -11.69 59.98 Favored 'General case' 0 N--CA 1.438 -1.073 0 C-N-CA 123.767 0.827 . . . . 0.0 111.463 172.106 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.464 ' CE2' ' HB3' ' A' ' 41' ' ' GLN . 68.0 m-85 -137.27 156.66 75.21 Favored Pre-proline 0 N--CA 1.443 -0.812 0 C-N-CA 123.972 0.909 . . . . 0.0 112.151 -167.146 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.8 121.5 8.56 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 N-CA-C 105.645 -2.483 . . . . 0.0 105.645 166.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -44.5 -40.52 5.67 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 116.306 1.965 . . . . 0.0 116.306 -166.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.44 -13.78 31.61 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 123.783 0.706 . . . . 0.0 113.657 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.06 -21.19 66.0 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.859 1.263 . . . . 0.0 112.449 171.093 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.8 t -142.84 137.03 29.33 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-O 122.988 1.375 . . . . 0.0 111.107 -176.44 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 19.3 t -66.98 -53.45 33.93 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.615 0 CA-C-N 113.852 -1.522 . . . . 0.0 108.926 -178.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 2.4 m -59.81 -46.65 93.45 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 -178.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 42.2 t -63.0 -30.65 71.77 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.952 1.301 . . . . 0.0 109.924 -176.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 64.5 m -68.0 -24.81 65.17 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 118.663 -0.684 . . . . 0.0 111.893 174.073 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -74.08 -40.22 43.31 Favored Glycine 0 N--CA 1.471 1.001 0 CA-C-O 124.288 2.049 . . . . 0.0 111.193 167.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -76.63 -37.67 55.97 Favored 'General case' 0 N--CA 1.411 -2.395 0 CA-C-N 111.055 -2.573 . . . . 0.0 116.848 -162.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 . . . . . 0 N--CA 1.449 -0.501 0 C-N-CA 119.651 -0.82 . . . . 0.0 110.766 169.846 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.0 t0 . . . . . 0 CA--C 1.536 0.417 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -51.62 -36.37 60.49 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 124.48 3.453 . . . . 0.0 112.37 -169.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 95.4 m -92.97 -8.73 42.25 Favored 'General case' 0 N--CA 1.436 -1.156 0 C-N-CA 126.538 1.935 . . . . 0.0 113.279 -169.152 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 29.4 tp60 -62.89 -24.97 68.08 Favored 'General case' 0 N--CA 1.446 -0.655 0 O-C-N 121.596 -0.69 . . . . 0.0 110.659 178.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -57.63 -56.78 17.52 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 123.424 0.689 . . . . 0.0 109.594 168.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 20.2 mp0 -59.06 -43.39 91.71 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 123.646 0.778 . . . . 0.0 110.203 -177.654 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.23 -44.11 71.44 Favored 'General case' 0 C--N 1.339 0.133 0 C-N-CA 124.404 1.081 . . . . 0.0 112.209 174.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 97.4 m -60.55 -45.64 93.14 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 117.498 0.135 . . . . 0.0 110.915 172.101 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 61.0 mm-40 -63.16 -23.65 67.53 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 117.577 -1.202 . . . . 0.0 112.745 178.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 43.7 mm -57.05 -54.16 33.76 Favored 'Isoleucine or valine' 0 C--N 1.342 0.254 0 CA-C-N 120.659 1.572 . . . . 0.0 109.233 172.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 34.7 mm-40 -58.75 -54.01 51.88 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 124.02 0.825 . . . . 0.0 109.086 -179.205 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.2 mptp? -66.81 -32.21 73.35 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 118.944 -1.102 . . . . 0.0 111.709 -174.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 24.7 t -56.42 -48.35 77.15 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 119.381 0.991 . . . . 0.0 108.841 169.029 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.32 -46.8 85.49 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 123.216 0.606 . . . . 0.0 110.628 179.297 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -56.97 -45.58 82.78 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.739 0.816 . . . . 0.0 111.205 174.021 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.95 -12.57 55.83 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.027 0.931 . . . . 0.0 113.437 175.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.7 m-80 -124.31 8.68 8.48 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.617 1.167 . . . . 0.0 112.228 -173.164 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 58.32 40.19 24.75 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 122.426 1.108 . . . . 0.0 110.913 179.619 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.255 6.9 m-85 71.98 13.64 5.92 Favored 'General case' 0 N--CA 1.445 -0.701 0 C-N-CA 127.817 2.447 . . . . 0.0 114.619 168.865 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 67.2 mtm -71.01 83.72 0.69 Allowed 'General case' 0 N--CA 1.44 -0.942 0 C-N-CA 125.144 1.378 . . . . 0.0 109.474 170.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -55.89 -22.11 23.9 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.949 0.9 . . . . 0.0 111.973 173.602 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 7.0 m -56.99 -34.18 67.87 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 126.728 2.011 . . . . 0.0 113.086 169.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 52.4 mmtt -74.89 -46.2 37.66 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 124.052 0.941 . . . . 0.0 108.74 171.813 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.3 m -73.73 6.13 3.45 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 125.133 1.373 . . . . 0.0 113.191 -174.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 40.0 mm-40 -54.93 -31.87 60.72 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 119.182 0.901 . . . . 0.0 110.139 167.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.33 -56.86 16.41 Favored 'General case' 0 C--N 1.345 0.391 0 C-N-CA 125.117 1.367 . . . . 0.0 111.433 174.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.7 p -73.69 -27.71 23.45 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 C-N-CA 123.843 0.857 . . . . 0.0 110.083 -174.308 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 63.6 mt -61.03 -49.53 84.34 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 N-CA-C 106.605 -1.628 . . . . 0.0 106.605 168.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -55.98 -30.84 62.37 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 118.915 0.78 . . . . 0.0 111.849 174.318 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -69.14 -46.19 68.24 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 118.862 0.756 . . . . 0.0 111.632 173.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.401 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.5 mt -55.74 -34.03 64.81 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-N 119.005 0.821 . . . . 0.0 109.577 172.384 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -70.39 -54.72 11.3 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 125.086 1.355 . . . . 0.0 111.648 -176.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 62.3 mttm -61.45 -34.7 75.88 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 124.728 1.211 . . . . 0.0 110.779 176.425 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 50.8 t -63.82 -51.01 66.65 Favored 'General case' 0 N--CA 1.444 -0.77 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 169.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 53.9 t -61.77 -50.07 73.82 Favored 'General case' 0 CA--C 1.515 -0.379 0 C-N-CA 123.446 0.698 . . . . 0.0 112.084 -172.029 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.51 -1.8 5.53 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 124.629 1.172 . . . . 0.0 111.98 -176.139 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.442 ' HB3' ' CE2' ' A' ' 42' ' ' TYR . 2.3 tp-100 -79.64 -8.12 58.99 Favored 'General case' 0 N--CA 1.438 -1.042 0 C-N-CA 124.589 1.156 . . . . 0.0 111.123 174.2 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.442 ' CE2' ' HB3' ' A' ' 41' ' ' GLN . 79.2 m-85 -141.6 163.1 43.23 Favored Pre-proline 0 N--CA 1.441 -0.913 0 C-N-CA 125.446 1.498 . . . . 0.0 111.024 -168.264 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -67.81 135.46 35.54 Favored 'Trans proline' 0 CA--C 1.537 0.638 0 N-CA-C 106.35 -2.212 . . . . 0.0 106.35 165.658 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -55.1 -29.47 57.7 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 114.889 1.44 . . . . 0.0 114.889 -168.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -67.86 -9.17 55.78 Favored Glycine 0 CA--C 1.533 1.201 0 CA-C-O 119.062 -0.855 . . . . 0.0 113.922 177.278 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 41.4 tpt85 -60.89 -31.97 71.44 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 119.171 1.486 . . . . 0.0 112.221 175.207 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.4 t -144.79 138.19 26.94 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 123.538 0.735 . . . . 0.0 110.273 -168.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 11.0 t -63.59 -56.75 15.15 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 CA-C-N 114.748 -1.115 . . . . 0.0 108.743 -178.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.2 m -59.01 -40.7 81.28 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 123.571 0.748 . . . . 0.0 110.438 -176.281 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 6.9 t -66.64 -37.84 85.67 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.82 1.248 . . . . 0.0 109.648 179.016 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 27.1 p -65.56 -25.07 67.26 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 121.788 -0.57 . . . . 0.0 111.051 174.207 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.89 -26.77 68.26 Favored Glycine 0 C--N 1.346 1.095 0 CA-C-O 121.759 0.644 . . . . 0.0 112.423 170.049 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.401 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.4 OUTLIER -80.43 -46.51 15.84 Favored 'General case' 0 N--CA 1.429 -1.523 0 N-CA-C 116.043 1.868 . . . . 0.0 116.043 -164.641 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 71.2 mt-10 . . . . . 0 CA--C 1.542 0.657 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.54 172.291 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.4 t0 . . . . . 0 N--CA 1.446 -0.667 0 N-CA-C 106.288 -1.745 . . . . 0.0 106.288 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -60.18 -37.23 84.9 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 123.211 2.607 . . . . 0.0 111.964 -171.229 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 93.5 m -92.01 -9.51 42.61 Favored 'General case' 0 N--CA 1.443 -0.791 0 C-N-CA 125.189 1.396 . . . . 0.0 113.047 -167.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 20.1 tp60 -59.53 -25.51 64.57 Favored 'General case' 0 N--CA 1.439 -0.993 0 CA-C-O 118.99 -0.529 . . . . 0.0 110.063 172.087 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 56.5 tptt -56.35 -61.68 2.24 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.895 1.278 . . . . 0.0 109.122 167.439 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 19.5 mp0 -57.91 -42.34 84.54 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 118.826 -0.607 . . . . 0.0 110.36 -177.431 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -56.56 -40.52 75.32 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.495 1.118 . . . . 0.0 112.388 174.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 96.6 m -64.63 -45.01 88.67 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 123.338 0.655 . . . . 0.0 111.27 170.234 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -63.76 -26.33 68.59 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-O 117.434 -1.269 . . . . 0.0 111.958 -179.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 12.1 mm -57.06 -50.11 77.42 Favored 'Isoleucine or valine' 0 C--N 1.34 0.192 0 CA-C-N 120.439 1.472 . . . . 0.0 109.036 170.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 47.2 mm-40 -60.18 -49.54 77.24 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 -174.127 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 26.8 mttp -71.71 -37.51 70.64 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 124.272 1.029 . . . . 0.0 111.943 -176.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 11.3 t -53.23 -43.34 67.21 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 108.463 -0.939 . . . . 0.0 108.463 169.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.01 -45.61 90.26 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 -178.075 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -64.57 -41.78 96.06 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 123.852 0.861 . . . . 0.0 110.521 179.11 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.22 -11.93 17.44 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.172 0.804 . . . . 0.0 113.172 171.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 55.4 m-80 -126.32 9.65 7.3 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.067 1.347 . . . . 0.0 112.257 -175.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 12.6 m 54.48 42.01 31.61 Favored 'General case' 0 C--N 1.345 0.389 0 CA-C-O 122.68 1.229 . . . . 0.0 111.983 -178.16 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.264 7.3 m-85 73.36 13.45 4.61 Favored 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 128.523 2.729 . . . . 0.0 114.526 168.046 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 66.7 mtm -69.6 85.02 0.44 Allowed 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 125.121 1.368 . . . . 0.0 109.761 169.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -54.46 -23.65 16.99 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.376 0.671 . . . . 0.0 111.538 171.09 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.1 m -52.73 -41.29 63.84 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 126.161 1.784 . . . . 0.0 112.151 170.082 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.3 mmtm -71.85 -47.8 50.54 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.28 1.032 . . . . 0.0 108.926 175.034 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.3 m -70.95 1.0 6.16 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 124.679 1.191 . . . . 0.0 112.919 -175.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 74.0 mm-40 -55.45 -29.53 58.84 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 119.635 1.107 . . . . 0.0 110.131 166.37 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.29 -59.25 5.21 Favored 'General case' 0 C--N 1.345 0.378 0 C-N-CA 124.946 1.298 . . . . 0.0 111.371 173.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 14.9 p -72.46 -29.15 30.18 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.819 0 C-N-CA 124.057 0.943 . . . . 0.0 109.909 -174.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 60.9 mt -60.69 -48.53 88.32 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 N-CA-C 106.263 -1.754 . . . . 0.0 106.263 169.077 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.41 HE22 ' NH1' ' A' ' 36' ' ' ARG . 0.9 OUTLIER -61.6 -28.99 69.75 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 119.637 1.108 . . . . 0.0 113.224 174.192 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 46.4 tt0 -67.11 -39.18 86.65 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 119.419 1.009 . . . . 0.0 109.973 172.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.438 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -60.07 -30.48 69.25 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 125.726 1.61 . . . . 0.0 109.084 175.294 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.41 ' NH1' HE22 ' A' ' 33' ' ' GLN . 18.9 mmt85 -71.89 -50.94 24.91 Favored 'General case' 0 C--N 1.343 0.292 0 C-N-CA 123.982 0.913 . . . . 0.0 108.567 -179.427 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -63.51 -29.78 71.0 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 124.755 1.222 . . . . 0.0 111.224 178.358 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 51.7 t -67.96 -55.44 12.73 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 167.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 44.3 t -59.61 -44.32 93.45 Favored 'General case' 0 C--N 1.328 -0.336 0 O-C-N 121.107 -0.995 . . . . 0.0 112.904 -170.253 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.25 -0.67 10.45 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 113.216 0.821 . . . . 0.0 113.216 -174.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.528 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 13.2 tt0 -93.62 -9.31 38.41 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 126.891 2.076 . . . . 0.0 111.914 -169.695 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.528 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 81.2 m-85 -133.84 163.08 53.72 Favored Pre-proline 0 N--CA 1.448 -0.537 0 C-N-CA 124.681 1.193 . . . . 0.0 111.625 -167.753 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -68.84 94.26 0.45 Allowed 'Trans proline' 0 N--CA 1.456 -0.723 0 N-CA-C 104.743 -2.83 . . . . 0.0 104.743 164.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.7 mptp? -39.08 -28.74 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 128.498 2.719 . . . . 0.0 117.898 -164.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -56.27 -17.11 16.82 Favored Glycine 0 CA--C 1.54 1.636 0 CA-C-N 120.033 1.288 . . . . 0.0 113.597 169.162 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -54.4 -24.1 18.47 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 127.965 2.506 . . . . 0.0 111.52 168.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.6 t -140.5 132.26 27.4 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-O 123.355 1.55 . . . . 0.0 113.33 -172.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 20.9 t -70.54 -52.23 30.8 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.717 0 CA-C-N 112.723 -2.035 . . . . 0.0 108.887 176.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.9 m -59.38 -45.49 93.39 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 CA-C-O 118.828 -0.606 . . . . 0.0 109.542 -179.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 35.1 t -62.88 -33.27 74.94 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.684 1.594 . . . . 0.0 109.953 -179.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 54.4 m -66.39 -25.19 66.66 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.24 0.616 . . . . 0.0 111.391 173.043 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.38 -47.57 28.22 Favored Glycine 0 N--CA 1.473 1.163 0 CA-C-O 124.527 2.182 . . . . 0.0 109.638 166.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.438 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 1.6 t80 -66.58 -36.6 83.02 Favored 'General case' 0 N--CA 1.408 -2.528 0 CA-C-N 110.917 -2.642 . . . . 0.0 116.325 -164.659 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 . . . . . 0 C--N 1.32 -0.681 0 CA-C-O 118.281 -0.866 . . . . 0.0 111.634 173.688 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.3 t0 . . . . . 0 CA--C 1.536 0.428 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -55.9 -29.85 74.73 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 124.54 3.493 . . . . 0.0 113.325 -171.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 88.7 m -96.78 -12.62 23.42 Favored 'General case' 0 N--CA 1.433 -1.28 0 C-N-CA 125.922 1.689 . . . . 0.0 113.905 -168.504 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 18.9 tp60 -62.02 -24.7 67.22 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 117.98 0.355 . . . . 0.0 111.627 -176.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.4 ttpp -70.88 -45.86 63.63 Favored 'General case' 0 CA--C 1.532 0.275 0 O-C-N 121.522 -0.736 . . . . 0.0 111.043 173.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -63.26 -40.36 97.19 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.458 0.703 . . . . 0.0 109.892 178.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -53.15 -40.51 64.32 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 124.631 1.172 . . . . 0.0 113.046 169.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 72.2 m -58.71 -46.05 88.18 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 110.443 -0.206 . . . . 0.0 110.443 174.022 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -60.93 -27.9 68.55 Favored 'General case' 0 CA--C 1.528 0.127 0 CA-C-O 118.112 -0.947 . . . . 0.0 112.691 178.437 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 21.8 mm -57.92 -54.32 33.49 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.473 0 CA-C-N 119.444 1.02 . . . . 0.0 109.339 173.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 36.0 mm-40 -58.15 -55.14 38.78 Favored 'General case' 0 N--CA 1.444 -0.764 0 O-C-N 124.365 1.041 . . . . 0.0 108.864 -177.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.65 -32.96 74.62 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 118.209 -1.396 . . . . 0.0 112.045 -175.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 31.0 t -56.46 -47.5 79.04 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 119.483 1.038 . . . . 0.0 109.127 169.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.96 -46.57 87.74 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 123.59 0.756 . . . . 0.0 110.629 179.368 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -57.08 -44.2 82.89 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.878 0.871 . . . . 0.0 111.293 173.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.91 -11.81 57.41 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.039 0.935 . . . . 0.0 113.434 174.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 50.2 m-80 -126.42 9.47 7.21 Favored 'General case' 0 C--N 1.343 0.31 0 C-N-CA 124.507 1.123 . . . . 0.0 112.656 -172.543 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 14.8 m 58.12 40.51 25.06 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 122.445 1.117 . . . . 0.0 111.05 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.255 6.7 m-85 71.99 13.02 6.0 Favored 'General case' 0 N--CA 1.444 -0.736 0 C-N-CA 127.888 2.475 . . . . 0.0 114.791 168.448 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 63.4 mtm -69.61 86.92 0.47 Allowed 'General case' 0 N--CA 1.441 -0.91 0 C-N-CA 125.116 1.367 . . . . 0.0 109.917 170.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -56.05 -20.94 19.01 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.089 0.556 . . . . 0.0 111.7 170.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 6.4 m -58.25 -37.39 74.84 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 127.56 2.344 . . . . 0.0 113.014 169.333 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 56.9 mmtt -75.75 -48.68 20.8 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 124.252 1.021 . . . . 0.0 108.736 173.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 83.9 m -71.33 6.57 1.68 Allowed 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 125.338 1.455 . . . . 0.0 112.95 -177.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -52.14 -32.34 35.24 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 120.129 1.332 . . . . 0.0 111.914 169.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.56 -56.23 24.54 Favored 'General case' 0 C--N 1.342 0.282 0 C-N-CA 125.117 1.367 . . . . 0.0 111.649 173.035 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.8 p -75.49 -29.51 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.872 0 C-N-CA 124.004 0.922 . . . . 0.0 109.934 -174.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.5 mp -58.38 -49.35 82.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 N-CA-C 105.648 -1.982 . . . . 0.0 105.648 167.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.4 ' HA ' ' CG ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -59.75 -22.77 62.55 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 118.896 0.771 . . . . 0.0 112.778 177.987 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -76.82 -41.44 44.33 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 119.39 -0.924 . . . . 0.0 110.406 173.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.7 mt -62.8 -30.85 71.78 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 119.364 0.984 . . . . 0.0 110.667 170.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.4 ' CG ' ' HA ' ' A' ' 33' ' ' GLN . 25.2 mmt85 -62.4 -57.68 10.4 Favored 'General case' 0 C--N 1.339 0.135 0 CA-C-N 119.73 1.15 . . . . 0.0 108.307 176.266 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 20.4 pttm -69.62 -23.09 63.45 Favored 'General case' 0 C--O 1.234 0.241 0 O-C-N 123.484 0.49 . . . . 0.0 111.46 -175.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 46.7 t -68.21 -54.15 19.83 Favored 'General case' 0 N--CA 1.439 -1.0 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 166.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.0 t -61.55 -50.59 72.04 Favored 'General case' 0 CA--C 1.516 -0.362 0 C-N-CA 124.691 1.196 . . . . 0.0 112.912 -169.33 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.76 0.06 3.65 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.988 0.915 . . . . 0.0 112.82 -173.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.529 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 10.6 tt0 -84.58 -8.87 58.75 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 127.041 2.136 . . . . 0.0 111.378 179.075 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.529 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 81.5 m-85 -137.46 155.76 75.31 Favored Pre-proline 0 N--CA 1.439 -1.011 0 C-N-CA 126.813 2.045 . . . . 0.0 110.87 -166.635 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -69.51 105.99 1.54 Allowed 'Trans proline' 0 N--CA 1.457 -0.653 0 N-CA-C 104.233 -3.026 . . . . 0.0 104.233 165.754 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 63.0 pttt -39.27 -34.25 0.18 Allowed 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 118.772 2.878 . . . . 0.0 118.772 -163.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -55.3 -18.75 14.78 Favored Glycine 0 CA--C 1.541 1.684 0 CA-C-N 120.346 1.43 . . . . 0.0 114.202 172.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 4.2 tpm_? -57.82 -15.73 9.26 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 128.069 2.547 . . . . 0.0 112.598 169.056 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.1 t -148.49 137.52 21.72 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-O 122.816 1.293 . . . . 0.0 111.587 177.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 15.9 t -68.08 -53.25 31.0 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 CA-C-N 113.867 -1.515 . . . . 0.0 108.664 177.369 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.6 m -60.57 -42.29 91.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 CA-C-O 118.768 -0.634 . . . . 0.0 110.217 -177.501 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 13.0 t -64.61 -36.36 83.99 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.953 1.701 . . . . 0.0 110.274 177.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.9 m -66.04 -27.18 67.91 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 119.081 -0.485 . . . . 0.0 110.686 172.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.69 -36.18 67.04 Favored Glycine 0 C--N 1.343 0.968 0 CA-C-O 123.072 1.373 . . . . 0.0 111.457 168.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -73.51 -42.5 61.72 Favored 'General case' 0 N--CA 1.422 -1.869 0 N-CA-C 116.438 2.014 . . . . 0.0 116.438 -164.783 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 . . . . . 0 N--CA 1.446 -0.635 0 CA-C-O 118.472 -0.775 . . . . 0.0 110.359 174.82 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 37.1 t0 . . . . . 0 N--CA 1.449 -0.493 0 N-CA-C 108.65 -0.871 . . . . 0.0 108.65 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -58.51 -31.03 93.47 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 123.988 3.125 . . . . 0.0 112.865 -174.465 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 56.2 m -93.75 -10.27 34.81 Favored 'General case' 0 N--CA 1.438 -1.041 0 C-N-CA 125.06 1.344 . . . . 0.0 112.523 -171.91 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.6 tp60 -62.74 -26.58 68.77 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 118.821 0.737 . . . . 0.0 110.623 178.344 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -56.48 -54.09 49.84 Favored 'General case' 0 C--O 1.226 -0.168 0 C-N-CA 123.745 0.818 . . . . 0.0 109.942 169.364 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -63.94 -46.79 83.15 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 118.47 -0.776 . . . . 0.0 109.604 -178.202 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -51.06 -40.05 57.42 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.772 1.229 . . . . 0.0 112.969 171.3 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 61.2 m -62.2 -43.0 99.81 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 119.407 -0.33 . . . . 0.0 110.642 172.2 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -64.73 -29.97 70.96 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 117.346 -1.311 . . . . 0.0 112.981 177.339 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.9 mp -57.39 -50.58 76.49 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 CA-C-N 121.021 1.737 . . . . 0.0 109.166 169.26 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 34.2 mm-40 -59.53 -54.59 44.79 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 178.584 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 53.6 mmtt -68.42 -30.8 69.78 Favored 'General case' 0 C--O 1.227 -0.116 0 C-N-CA 118.697 -1.201 . . . . 0.0 111.418 -172.807 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 19.9 t -56.21 -48.94 75.44 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 168.488 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.68 -47.35 82.58 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 118.866 -0.588 . . . . 0.0 110.523 178.808 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -56.74 -46.49 81.33 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.528 0.731 . . . . 0.0 111.199 174.618 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.71 -13.71 59.82 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.113 0.965 . . . . 0.0 113.518 175.759 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.6 m-80 -122.05 8.18 9.82 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 124.772 1.229 . . . . 0.0 111.946 -173.385 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 58.08 40.42 25.25 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 119.566 1.076 . . . . 0.0 110.853 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.261 7.0 m-85 72.29 14.27 5.51 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 127.816 2.447 . . . . 0.0 114.457 168.876 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 68.4 mtm -70.4 82.42 0.56 Allowed 'General case' 0 N--CA 1.441 -0.882 0 C-N-CA 125.212 1.405 . . . . 0.0 109.793 169.836 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -53.19 -24.14 10.17 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.366 1.066 . . . . 0.0 111.668 171.684 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.6 m -52.11 -40.08 60.76 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 126.517 1.927 . . . . 0.0 112.409 170.113 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 45.7 mmtt -72.16 -48.62 42.07 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 124.481 1.113 . . . . 0.0 108.706 174.813 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 78.9 m -73.59 1.38 10.21 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.299 1.44 . . . . 0.0 113.614 -173.763 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 53.4 mm-40 -52.65 -34.13 50.1 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 119.681 1.128 . . . . 0.0 111.222 169.123 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.23 -54.86 42.02 Favored 'General case' 0 C--N 1.343 0.291 0 C-N-CA 125.02 1.328 . . . . 0.0 111.387 175.011 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.0 p -75.59 -31.19 22.81 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.831 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.236 -173.034 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 75.2 mt -58.98 -45.9 91.87 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 N-CA-C 106.656 -1.609 . . . . 0.0 106.656 168.489 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.37 -27.57 62.42 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 120.969 -1.082 . . . . 0.0 113.052 173.662 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -76.47 -29.78 57.03 Favored 'General case' 0 N--CA 1.437 -1.097 0 C-N-CA 119.571 -0.851 . . . . 0.0 110.86 175.656 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.6 mt -64.45 -29.71 70.76 Favored 'General case' 0 C--N 1.343 0.311 0 CA-C-N 119.688 1.131 . . . . 0.0 109.213 168.648 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 16.7 mmt85 -66.03 -55.81 14.77 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 119.805 1.184 . . . . 0.0 108.719 -178.808 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.9 pttp -66.25 -27.11 67.71 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.157 -178.83 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 42.7 t -65.43 -54.83 22.93 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 168.397 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.1 t -62.55 -46.38 88.63 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 124.127 0.971 . . . . 0.0 112.137 -169.191 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.418 ' HA ' ' HE3' ' A' ' 44' ' ' LYS . . . -67.55 -4.02 10.44 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.003 -0.999 . . . . 0.0 112.879 -178.241 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -86.2 -6.2 59.04 Favored 'General case' 0 N--CA 1.439 -1.014 0 C-N-CA 124.851 1.26 . . . . 0.0 111.697 -178.753 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 72.3 m-85 -136.0 159.76 69.87 Favored Pre-proline 0 N--CA 1.446 -0.642 0 C-N-CA 124.434 1.094 . . . . 0.0 111.387 -168.949 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -67.76 109.24 1.84 Allowed 'Trans proline' 0 N--CA 1.455 -0.764 0 N-CA-C 104.778 -2.816 . . . . 0.0 104.778 165.389 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.418 ' HE3' ' HA ' ' A' ' 40' ' ' ALA . 38.5 mmtm -39.78 -38.43 0.65 Allowed 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 117.164 2.283 . . . . 0.0 117.164 -165.372 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.58 -17.23 25.86 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 123.854 0.74 . . . . 0.0 113.936 175.718 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 2.0 ttm180 -66.77 -8.08 25.83 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 126.946 2.098 . . . . 0.0 112.653 172.266 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 5.8 t -147.34 136.21 22.14 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 122.912 1.339 . . . . 0.0 112.076 174.415 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 19.9 t -71.73 -50.78 36.54 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.74 0 CA-C-N 113.615 -1.63 . . . . 0.0 108.762 176.717 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.4 m -60.34 -43.68 94.25 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.335 0 CA-C-O 118.402 -0.809 . . . . 0.0 109.835 179.722 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 25.5 t -63.22 -34.57 77.94 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.011 1.724 . . . . 0.0 110.451 178.131 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 48.7 m -65.73 -28.93 69.41 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 122.998 0.519 . . . . 0.0 110.875 171.588 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -67.68 -40.71 90.19 Favored Glycine 0 C--N 1.344 0.995 0 CA-C-O 124.167 1.982 . . . . 0.0 110.952 167.432 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -73.94 -40.29 63.18 Favored 'General case' 0 N--CA 1.417 -2.122 0 CA-C-N 111.786 -2.207 . . . . 0.0 116.128 -164.581 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 . . . . . 0 C--N 1.322 -0.614 0 CA-C-O 118.324 -0.846 . . . . 0.0 110.638 170.929 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.8 t0 . . . . . 0 CA--C 1.539 0.553 0 N-CA-C 106.245 -1.761 . . . . 0.0 106.245 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -68.67 -17.79 42.63 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 125.097 3.865 . . . . 0.0 113.672 -169.532 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 98.6 m -105.32 -9.3 17.7 Favored 'General case' 0 N--CA 1.435 -1.224 0 C-N-CA 127.056 2.143 . . . . 0.0 111.835 -170.451 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 16.9 tp60 -67.41 -22.48 65.53 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.704 -171.467 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -70.36 -46.79 63.41 Favored 'General case' 0 C--O 1.225 -0.232 0 O-C-N 121.449 -0.782 . . . . 0.0 110.057 173.687 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 19.0 mp0 -65.27 -40.57 94.1 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 127.255 2.222 . . . . 0.0 108.237 -172.583 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -52.16 -43.26 63.99 Favored 'General case' 0 C--N 1.34 0.166 0 C-N-CA 126.166 1.787 . . . . 0.0 112.707 169.232 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 84.0 m -60.99 -45.13 96.06 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.925 0.393 . . . . 0.0 110.299 175.709 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -63.83 -22.54 66.96 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 117.711 -1.137 . . . . 0.0 112.541 179.278 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 31.6 mm -59.17 -54.72 30.36 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.216 0 CA-C-N 120.408 1.458 . . . . 0.0 109.17 171.271 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -61.52 -51.79 67.15 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 -177.739 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 16.6 mtpp -67.9 -30.72 70.14 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 118.245 -0.884 . . . . 0.0 111.568 -174.725 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 15.6 t -58.51 -47.87 82.71 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-N 119.41 1.004 . . . . 0.0 108.512 168.787 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.72 -47.15 83.24 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 123.339 0.655 . . . . 0.0 110.392 178.997 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -58.45 -42.23 86.9 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.983 0.913 . . . . 0.0 111.681 174.195 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.63 -10.68 57.58 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 174.374 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -128.33 9.02 6.07 Favored 'General case' 0 C--N 1.344 0.362 0 CA-C-N 119.421 1.009 . . . . 0.0 112.59 -171.852 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 16.2 m 61.03 38.87 16.96 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 119.496 1.044 . . . . 0.0 110.39 177.777 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.265 7.1 m-85 72.2 14.81 5.52 Favored 'General case' 0 N--CA 1.444 -0.735 0 C-N-CA 127.656 2.382 . . . . 0.0 114.431 168.788 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 58.7 mtm -70.9 85.94 0.69 Allowed 'General case' 0 N--CA 1.441 -0.9 0 C-N-CA 124.84 1.256 . . . . 0.0 109.881 170.616 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -52.56 -24.85 9.0 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.265 1.026 . . . . 0.0 111.149 169.556 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.4 m -53.77 -38.83 64.86 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 127.511 2.324 . . . . 0.0 113.013 170.409 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 9.9 mmpt? -75.74 -47.6 25.33 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 173.45 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.6 m -71.89 2.64 5.22 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.626 1.17 . . . . 0.0 113.401 -174.568 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -52.98 -30.96 38.16 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 119.439 1.018 . . . . 0.0 110.695 167.763 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.65 -59.58 5.21 Favored 'General case' 0 C--N 1.346 0.444 0 C-N-CA 125.616 1.566 . . . . 0.0 111.68 173.7 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.5 p -71.29 -29.5 36.14 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.716 0 C-N-CA 123.761 0.825 . . . . 0.0 110.08 -174.27 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 71.7 mt -59.91 -49.85 82.34 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 N-CA-C 106.543 -1.651 . . . . 0.0 106.543 169.239 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.4 ' HA ' ' CG ' ' A' ' 36' ' ' ARG . 1.0 OUTLIER -56.86 -25.3 56.19 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 119.451 1.023 . . . . 0.0 112.909 175.482 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -74.84 -41.55 59.66 Favored 'General case' 0 N--CA 1.44 -0.953 0 CA-C-N 118.925 0.784 . . . . 0.0 110.819 173.802 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.4 mt -62.92 -31.31 72.35 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-O 117.797 -1.097 . . . . 0.0 110.208 170.447 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.4 ' CG ' ' HA ' ' A' ' 33' ' ' GLN . 25.9 mmt85 -63.37 -56.4 16.64 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 120.067 1.303 . . . . 0.0 108.443 179.076 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.8 pttt -67.65 -28.4 67.68 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.951 -174.517 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 47.8 t -66.55 -54.51 22.86 Favored 'General case' 0 N--CA 1.44 -0.925 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 168.246 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.8 t -59.48 -50.06 75.4 Favored 'General case' 0 CA--C 1.512 -0.512 0 C-N-CA 124.332 1.053 . . . . 0.0 111.842 -169.573 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.11 -1.53 6.15 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.025 -0.989 . . . . 0.0 112.414 -174.608 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.468 ' HB3' ' CE2' ' A' ' 42' ' ' TYR . 2.0 tp-100 -81.9 -10.28 59.34 Favored 'General case' 0 N--CA 1.436 -1.158 0 C-N-CA 124.344 1.058 . . . . 0.0 111.578 174.76 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.468 ' CE2' ' HB3' ' A' ' 41' ' ' GLN . 68.7 m-85 -138.71 158.91 69.32 Favored Pre-proline 0 N--CA 1.445 -0.712 0 C-N-CA 124.187 0.995 . . . . 0.0 112.014 -167.666 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -72.1 147.62 48.92 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 121.735 1.623 . . . . 0.0 108.373 167.622 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -51.94 -42.93 63.23 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 -173.669 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.96 -14.24 23.11 Favored Glycine 0 CA--C 1.53 0.974 0 CA-C-O 119.032 -0.871 . . . . 0.0 113.257 -178.858 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.54 -17.08 56.71 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 118.894 1.347 . . . . 0.0 113.095 176.052 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 9.6 t -151.95 128.51 10.74 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-O 123.537 1.636 . . . . 0.0 112.901 -175.234 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 12.0 t -68.5 -50.85 52.56 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 CA-C-N 112.679 -2.055 . . . . 0.0 108.698 178.942 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 16.0 m -61.84 -43.53 97.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 CA-C-O 118.46 -0.781 . . . . 0.0 110.083 -178.578 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 18.5 t -63.86 -34.58 78.26 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.582 1.553 . . . . 0.0 110.227 177.886 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.0 m -65.07 -29.64 70.54 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 122.788 0.435 . . . . 0.0 110.675 171.99 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.1 -37.54 82.44 Favored Glycine 0 C--N 1.344 1.002 0 CA-C-O 123.089 1.383 . . . . 0.0 111.104 167.987 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -75.08 -40.25 60.25 Favored 'General case' 0 N--CA 1.417 -2.075 0 N-CA-C 117.097 2.258 . . . . 0.0 117.097 -163.74 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 . . . . . 0 CA--C 1.542 0.651 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.674 171.853 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.0 t0 . . . . . 0 N--CA 1.446 -0.669 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -55.25 -34.58 88.75 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 124.091 3.194 . . . . 0.0 112.77 -173.695 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 85.7 m -94.9 -13.09 25.76 Favored 'General case' 0 N--CA 1.436 -1.168 0 C-N-CA 125.403 1.481 . . . . 0.0 113.581 -168.305 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.1 tp60 -61.29 -26.57 67.87 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 122.99 0.516 . . . . 0.0 110.803 -179.968 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.2 ttpp -62.29 -54.31 42.57 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.521 0.728 . . . . 0.0 110.377 169.971 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 27.1 mm-40 -59.12 -44.83 92.04 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.405 0.682 . . . . 0.0 110.107 -177.293 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -51.26 -42.58 61.17 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 125.728 1.611 . . . . 0.0 112.626 170.846 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.401 ' HB3' ' HE2' ' A' ' 16' ' ' LYS . 93.8 m -61.66 -46.27 90.45 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 117.854 0.297 . . . . 0.0 110.931 173.004 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -62.59 -22.22 66.21 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 117.662 -1.161 . . . . 0.0 112.633 179.091 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 27.3 mm -57.78 -53.61 42.67 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.218 0 CA-C-N 120.397 1.453 . . . . 0.0 109.614 171.796 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 -58.64 -55.85 29.75 Favored 'General case' 0 N--CA 1.445 -0.678 0 O-C-N 124.19 0.932 . . . . 0.0 109.002 -179.316 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.401 ' HE2' ' HB3' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -66.65 -31.54 72.28 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 118.807 -1.157 . . . . 0.0 112.138 -175.004 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 24.1 t -55.67 -48.72 74.58 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 119.491 1.041 . . . . 0.0 108.758 169.18 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.44 -46.7 86.02 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-O 118.863 -0.589 . . . . 0.0 110.48 179.533 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -57.03 -46.33 82.47 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.419 0.688 . . . . 0.0 111.34 174.402 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.49 -13.03 57.95 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.262 1.025 . . . . 0.0 113.4 175.66 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -123.21 8.54 9.16 Favored 'General case' 0 C--N 1.342 0.26 0 C-N-CA 124.66 1.184 . . . . 0.0 111.959 -173.333 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.3 m 58.23 40.13 25.08 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 119.636 1.107 . . . . 0.0 110.863 179.415 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.26 7.0 m-85 72.19 13.98 5.65 Favored 'General case' 0 N--CA 1.443 -0.796 0 C-N-CA 127.957 2.503 . . . . 0.0 114.499 168.902 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 67.0 mtm -69.93 84.72 0.5 Allowed 'General case' 0 N--CA 1.44 -0.955 0 C-N-CA 125.204 1.402 . . . . 0.0 109.837 170.002 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -53.79 -25.07 17.48 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.502 0.721 . . . . 0.0 111.524 171.105 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.2 m -53.1 -38.64 62.77 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 126.413 1.885 . . . . 0.0 112.631 170.691 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.8 mmtm -72.95 -47.73 42.95 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.267 1.027 . . . . 0.0 108.671 173.454 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.3 m -73.74 3.24 6.76 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 124.797 1.239 . . . . 0.0 113.637 -173.074 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 64.2 mm-40 -54.82 -29.72 55.46 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.2 -0.937 . . . . 0.0 110.542 167.067 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.71 -55.39 35.75 Favored 'General case' 0 C--N 1.345 0.4 0 C-N-CA 125.567 1.547 . . . . 0.0 111.708 172.606 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.5 p -75.81 -29.37 20.14 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 C-N-CA 123.605 0.762 . . . . 0.0 110.16 -173.467 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 59.2 mt -61.04 -46.78 96.0 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 N-CA-C 106.058 -1.83 . . . . 0.0 106.058 168.213 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.81 -26.58 62.18 Favored 'General case' 0 N--CA 1.453 -0.304 0 O-C-N 120.853 -1.155 . . . . 0.0 113.436 172.884 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -76.39 -32.32 58.49 Favored 'General case' 0 N--CA 1.432 -1.33 0 C-N-CA 119.492 -0.883 . . . . 0.0 110.743 175.705 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.8 mt -64.02 -32.83 74.51 Favored 'General case' 0 C--O 1.22 -0.455 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 168.46 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.4 mmt85 -64.71 -57.23 9.55 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 119.913 1.233 . . . . 0.0 109.24 -179.119 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.9 pttp -64.95 -29.64 70.58 Favored 'General case' 0 C--O 1.233 0.186 0 O-C-N 123.543 0.527 . . . . 0.0 111.087 -176.082 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 51.1 t -65.27 -54.19 32.95 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 168.729 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 48.7 t -62.6 -47.07 85.39 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 121.514 -0.741 . . . . 0.0 111.838 -169.921 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.53 -0.89 7.34 Favored 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 124.484 1.114 . . . . 0.0 112.429 -176.728 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.408 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 1.8 tp-100 -77.28 -11.52 59.84 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-N 119.1 0.864 . . . . 0.0 111.572 171.667 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.408 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 54.1 m-85 -141.44 160.64 56.25 Favored Pre-proline 0 N--CA 1.438 -1.053 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -164.23 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -69.82 114.85 3.85 Favored 'Trans proline' 0 N--CA 1.455 -0.758 0 N-CA-C 105.283 -2.622 . . . . 0.0 105.283 165.069 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.43 -29.57 1.14 Allowed 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 117.586 2.439 . . . . 0.0 117.586 -166.577 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -54.1 -17.16 7.16 Favored Glycine 0 CA--C 1.538 1.509 0 CA-C-N 119.601 1.091 . . . . 0.0 114.075 171.852 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.4 ' HG2' ' CG ' ' A' ' 42' ' ' TYR . 8.3 tpm_? -52.16 -29.15 20.81 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 127.589 2.356 . . . . 0.0 112.386 168.017 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.4 t -149.25 139.82 22.55 Favored 'General case' 0 N--CA 1.439 -1.012 0 CA-C-O 122.804 1.288 . . . . 0.0 112.048 -168.277 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.1 t -67.79 -55.03 18.4 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.658 0 CA-C-N 113.747 -1.569 . . . . 0.0 108.704 176.655 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.3 m -61.19 -43.2 95.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 CA-C-O 118.382 -0.818 . . . . 0.0 109.954 -177.106 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 29.5 t -64.57 -32.07 73.56 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.4 1.48 . . . . 0.0 110.18 178.934 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 52.3 m -67.25 -26.93 66.82 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 119.075 -0.488 . . . . 0.0 110.893 171.742 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -71.0 -36.15 64.58 Favored Glycine 0 C--N 1.345 1.05 0 CA-C-O 123.798 1.776 . . . . 0.0 111.092 167.288 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -78.47 -40.3 35.91 Favored 'General case' 0 N--CA 1.412 -2.339 0 N-CA-C 116.293 1.96 . . . . 0.0 116.293 -163.846 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 . . . . . 0 N--CA 1.449 -0.5 0 C-N-CA 119.483 -0.887 . . . . 0.0 110.342 170.858 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 47.3 t0 . . . . . 0 CA--C 1.54 0.584 0 N-CA-C 109.589 -0.522 . . . . 0.0 109.589 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.54 -25.55 29.5 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 123.629 2.886 . . . . 0.0 112.4 -176.14 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 66.0 m -92.66 -11.51 33.93 Favored 'General case' 0 N--CA 1.435 -1.192 0 C-N-CA 124.518 1.127 . . . . 0.0 110.89 -170.699 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 21.4 tp60 -64.34 -25.0 67.84 Favored 'General case' 0 N--CA 1.442 -0.83 0 C-N-CA 123.36 0.664 . . . . 0.0 110.686 179.599 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -62.14 -53.83 49.79 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 123.477 0.711 . . . . 0.0 110.02 169.115 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -62.97 -38.89 92.9 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.043 0.537 . . . . 0.0 109.675 -176.662 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.32 -44.38 72.0 Favored 'General case' 0 C--N 1.342 0.272 0 C-N-CA 125.327 1.451 . . . . 0.0 112.222 169.784 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 85.3 m -58.54 -45.82 88.12 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 117.734 0.243 . . . . 0.0 110.531 173.573 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.0 mm-40 -67.3 -16.63 64.38 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 117.495 -1.24 . . . . 0.0 112.681 -179.864 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 42.2 mm -59.85 -54.3 36.59 Favored 'Isoleucine or valine' 0 C--N 1.34 0.17 0 CA-C-N 121.09 1.768 . . . . 0.0 107.847 169.118 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 50.9 mm-40 -57.27 -52.77 63.98 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.249 -0.887 . . . . 0.0 109.202 174.291 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 18.5 mmmt -65.34 -32.32 73.9 Favored 'General case' 0 C--N 1.334 -0.073 0 C-N-CA 118.741 -1.184 . . . . 0.0 111.757 -172.913 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 17.5 t -57.69 -51.45 69.47 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 169.72 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.65 -47.77 73.13 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.968 0.907 . . . . 0.0 110.876 178.229 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.453 ' HA ' ' CE1' ' A' ' 23' ' ' TYR . 0.6 OUTLIER -55.9 -45.36 78.68 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.024 0.93 . . . . 0.0 111.473 174.07 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.88 -10.99 60.57 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 114.381 1.252 . . . . 0.0 114.381 176.577 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -126.37 16.51 7.7 Favored 'General case' 0 C--N 1.343 0.321 0 CA-C-N 119.806 1.185 . . . . 0.0 113.749 -168.401 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 17.6 m 60.17 34.68 21.1 Favored 'General case' 0 C--N 1.345 0.401 0 CA-C-N 120.523 1.511 . . . . 0.0 110.285 -179.192 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.453 ' CE1' ' HA ' ' A' ' 19' ' ' GLN . 46.4 m-85 67.33 16.43 10.09 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 126.832 2.053 . . . . 0.0 113.719 168.406 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 65.2 mtm -73.7 90.98 1.86 Allowed 'General case' 0 N--CA 1.439 -0.987 0 C-N-CA 126.168 1.787 . . . . 0.0 109.114 175.368 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -54.68 -23.56 17.97 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.982 -0.449 . . . . 0.0 111.469 170.862 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.2 m -53.73 -41.32 66.94 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 126.588 1.955 . . . . 0.0 112.412 170.299 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 61.2 mmtt -71.29 -45.99 61.83 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 124.103 0.961 . . . . 0.0 108.891 173.581 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 86.3 m -73.97 3.47 6.79 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 124.336 1.054 . . . . 0.0 113.012 -172.88 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 79.8 mm-40 -56.45 -27.74 57.66 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.467 -0.771 . . . . 0.0 110.541 166.234 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.31 -60.46 3.78 Favored 'General case' 0 C--N 1.345 0.39 0 C-N-CA 125.403 1.481 . . . . 0.0 111.423 172.003 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.1 p -71.62 -25.92 25.35 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 C-N-CA 123.835 0.854 . . . . 0.0 110.004 -175.093 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 17.0 mt -60.02 -52.46 60.9 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 N-CA-C 106.684 -1.599 . . . . 0.0 106.684 168.101 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.446 ' HA ' ' CG ' ' A' ' 36' ' ' ARG . 8.6 tt0 -55.25 -36.65 66.29 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-O 118.792 -0.623 . . . . 0.0 110.305 178.588 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -65.25 -41.99 93.74 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 118.685 0.675 . . . . 0.0 111.703 176.065 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.451 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 0.7 OUTLIER -61.44 -38.59 87.72 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-O 117.005 -1.474 . . . . 0.0 110.418 173.236 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.446 ' CG ' ' HA ' ' A' ' 33' ' ' GLN 0.275 9.3 ptt85 -70.08 -39.76 75.4 Favored 'General case' 0 C--N 1.341 0.226 0 CA-C-N 120.66 1.573 . . . . 0.0 110.605 -179.865 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.8 mmtp -64.14 -37.1 86.22 Favored 'General case' 0 C--N 1.344 0.34 0 CA-C-N 118.716 0.689 . . . . 0.0 111.188 175.859 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 49.3 t -60.66 -53.18 60.5 Favored 'General case' 0 C--O 1.22 -0.448 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 170.528 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.3 t -57.56 -44.97 85.64 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 125.306 1.443 . . . . 0.0 113.142 -169.646 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.401 ' HA ' ' HE3' ' A' ' 44' ' ' LYS . . . -76.33 -1.11 25.15 Favored 'General case' 0 N--CA 1.441 -0.902 0 O-C-N 124.67 1.231 . . . . 0.0 112.631 -176.268 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.431 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 3.5 tp-100 -91.86 -1.85 57.13 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 124.23 1.012 . . . . 0.0 112.754 -168.827 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.481 ' HB2' ' CZ ' ' A' ' 46' ' ' ARG . 84.7 m-85 -142.56 165.97 23.66 Favored Pre-proline 0 N--CA 1.443 -0.781 0 C-N-CA 125.985 1.714 . . . . 0.0 110.641 -167.474 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -61.93 139.93 82.21 Favored 'Trans proline' 0 CA--C 1.538 0.68 0 C-N-CA 121.798 1.665 . . . . 0.0 109.433 169.164 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.401 ' HE3' ' HA ' ' A' ' 40' ' ' ALA . 41.1 mmtm -71.44 -5.51 33.43 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 114.699 1.37 . . . . 0.0 114.699 -169.186 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -86.86 -12.79 68.01 Favored Glycine 0 CA--C 1.533 1.179 0 CA-C-O 118.636 -1.091 . . . . 0.0 113.669 169.933 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.481 ' CZ ' ' HB2' ' A' ' 42' ' ' TYR . 0.0 OUTLIER -74.39 -9.85 59.0 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.768 1.784 . . . . 0.0 112.757 -173.596 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 16.0 t -145.4 146.26 31.48 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 120.909 -1.119 . . . . 0.0 112.053 -174.656 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 23.6 t -84.26 -55.11 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 C-N-CA 126.177 1.791 . . . . 0.0 108.826 173.103 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.8 m -58.22 -41.35 80.75 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 118.212 0.46 . . . . 0.0 110.745 -173.724 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 9.2 t -64.22 -34.48 78.19 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.281 1.433 . . . . 0.0 109.871 -179.928 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.1 p -64.94 -27.16 68.65 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 121.995 -0.44 . . . . 0.0 111.016 174.065 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.09 -45.12 58.01 Favored Glycine 0 C--N 1.348 1.196 0 CA-C-O 123.902 1.834 . . . . 0.0 110.172 168.391 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.451 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.6 OUTLIER -63.73 -39.74 95.04 Favored 'General case' 0 N--CA 1.415 -2.19 0 CA-C-N 111.937 -2.131 . . . . 0.0 115.354 -167.276 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 . . . . . 0 C--N 1.321 -0.667 0 CA-C-O 118.649 -0.691 . . . . 0.0 111.079 178.747 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.9 t0 . . . . . 0 N--CA 1.441 -0.883 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -60.47 -16.63 43.21 Favored 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 124.31 3.34 . . . . 0.0 114.948 -173.65 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 64.2 m -108.57 -6.97 15.82 Favored 'General case' 0 N--CA 1.441 -0.92 0 C-N-CA 127.027 2.131 . . . . 0.0 112.272 -170.465 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 8.0 tp60 -67.89 -22.79 65.07 Favored 'General case' 0 N--CA 1.447 -0.597 0 O-C-N 121.615 -0.678 . . . . 0.0 112.278 -173.018 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 47.5 tptt -67.26 -49.56 63.93 Favored 'General case' 0 C--O 1.226 -0.143 0 CA-C-O 122.028 0.918 . . . . 0.0 109.446 173.456 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 20.4 mp0 -61.64 -43.13 99.44 Favored 'General case' 0 N--CA 1.442 -0.86 0 C-N-CA 127.641 2.377 . . . . 0.0 107.995 -173.962 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -53.78 -41.32 67.1 Favored 'General case' 0 C--N 1.341 0.213 0 C-N-CA 126.562 1.945 . . . . 0.0 114.016 169.797 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.0 m -63.27 -44.84 93.98 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 122.408 0.283 . . . . 0.0 110.263 173.716 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -64.83 -24.88 67.68 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 117.688 -1.148 . . . . 0.0 112.243 179.739 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 37.5 mm -56.54 -50.87 71.36 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.221 0 CA-C-N 120.273 1.397 . . . . 0.0 109.4 169.453 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 45.8 mm-40 -59.97 -56.28 23.68 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 106.971 -1.492 . . . . 0.0 106.971 -175.145 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 44.5 mttt -70.41 -30.19 67.0 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 118.182 -0.913 . . . . 0.0 111.233 -171.618 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 18.9 t -57.26 -47.06 82.37 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 169.185 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.26 -45.75 90.36 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 118.435 -0.793 . . . . 0.0 110.169 179.649 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -58.29 -45.68 87.5 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 119.328 0.967 . . . . 0.0 111.301 174.255 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.93 -13.94 58.53 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 175.862 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -123.86 9.25 8.8 Favored 'General case' 0 C--N 1.343 0.322 0 C-N-CA 124.302 1.041 . . . . 0.0 112.24 -172.928 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.4 m 58.03 40.45 25.39 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 122.404 1.097 . . . . 0.0 110.842 179.369 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.265 6.8 m-85 72.25 14.36 5.53 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 127.801 2.44 . . . . 0.0 114.428 168.79 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 63.0 mtm -69.45 86.27 0.44 Allowed 'General case' 0 N--CA 1.442 -0.843 0 C-N-CA 125.175 1.39 . . . . 0.0 110.329 170.122 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -54.36 -22.97 13.68 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.457 1.103 . . . . 0.0 111.323 169.486 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.6 m -58.02 -40.64 81.35 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 127.027 2.131 . . . . 0.0 112.631 170.085 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.7 mmtm -72.91 -47.73 43.2 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 124.138 0.975 . . . . 0.0 108.561 174.375 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.0 m -70.14 3.33 2.87 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.034 1.334 . . . . 0.0 113.424 -176.791 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 85.1 mm-40 -53.37 -31.7 45.86 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 119.304 0.956 . . . . 0.0 111.122 167.204 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.64 -50.16 74.93 Favored 'General case' 0 C--N 1.344 0.362 0 C-N-CA 125.028 1.331 . . . . 0.0 112.116 174.851 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.7 p -80.91 -29.96 11.66 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.809 0 C-N-CA 123.391 0.677 . . . . 0.0 109.845 -174.256 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 68.8 mt -63.25 -40.66 89.9 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 169.366 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.67 -34.71 59.61 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 123.727 0.811 . . . . 0.0 112.001 170.232 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -74.85 -42.8 57.25 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 119.806 -0.758 . . . . 0.0 110.846 179.504 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.4 mt -64.23 -30.9 71.94 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 118.276 -0.869 . . . . 0.0 110.311 174.425 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.22 -61.88 2.27 Favored 'General case' 0 CA--C 1.518 -0.269 0 C-N-CA 124.437 1.095 . . . . 0.0 108.756 175.661 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -64.58 -28.12 69.41 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 114.372 -1.286 . . . . 0.0 110.66 -173.499 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 49.4 t -66.28 -55.37 16.41 Favored 'General case' 0 N--CA 1.442 -0.83 0 C-N-CA 123.511 0.724 . . . . 0.0 109.258 168.273 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 47.8 t -60.0 -43.81 94.95 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 123.94 0.896 . . . . 0.0 112.516 -170.859 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.85 -4.32 15.85 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.845 -1.07 . . . . 0.0 113.006 -176.313 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.428 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 3.1 tp-100 -91.7 -4.82 54.67 Favored 'General case' 0 N--CA 1.437 -1.084 0 C-N-CA 125.355 1.462 . . . . 0.0 112.122 -172.6 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.428 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 78.9 m-85 -139.15 161.32 58.3 Favored Pre-proline 0 N--CA 1.446 -0.628 0 C-N-CA 124.132 0.973 . . . . 0.0 112.244 -168.133 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -69.48 98.99 0.69 Allowed 'Trans proline' 0 N--CA 1.456 -0.709 0 N-CA-C 105.096 -2.694 . . . . 0.0 105.096 165.384 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? -39.34 -30.69 0.07 Allowed 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 117.904 2.557 . . . . 0.0 117.904 -165.556 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -54.81 -18.44 11.28 Favored Glycine 0 CA--C 1.541 1.659 0 CA-C-N 120.219 1.372 . . . . 0.0 114.097 170.021 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.0 tpm_? -55.8 -24.04 33.63 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 127.95 2.5 . . . . 0.0 112.053 168.957 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.5 t -144.64 130.16 18.93 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-O 123.387 1.565 . . . . 0.0 112.497 -172.298 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.7 t -69.82 -49.8 54.35 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.758 0 CA-C-N 112.952 -1.931 . . . . 0.0 108.72 176.677 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.4 m -62.58 -42.04 94.38 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-O 118.512 -0.756 . . . . 0.0 110.352 -178.319 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.7 t -64.82 -35.28 80.6 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.757 1.623 . . . . 0.0 110.191 176.235 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.3 m -65.44 -28.9 69.56 Favored 'General case' 0 CA--C 1.535 0.398 0 O-C-N 122.082 -0.386 . . . . 0.0 110.525 171.727 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.56 -32.99 71.42 Favored Glycine 0 C--N 1.345 1.052 0 CA-C-O 122.801 1.223 . . . . 0.0 111.366 167.939 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -80.21 -42.08 23.98 Favored 'General case' 0 N--CA 1.422 -1.839 0 N-CA-C 116.103 1.89 . . . . 0.0 116.103 -165.211 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 . . . . . 0 C--N 1.321 -0.632 0 C-N-CA 119.841 -0.744 . . . . 0.0 110.404 171.014 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.2 t0 . . . . . 0 CA--C 1.546 0.815 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -61.52 -30.95 87.23 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 125.247 3.964 . . . . 0.0 113.056 -172.36 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 87.9 m -94.16 -15.55 24.53 Favored 'General case' 0 N--CA 1.436 -1.163 0 C-N-CA 125.134 1.374 . . . . 0.0 112.497 -168.552 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 21.7 tp60 -61.15 -24.62 66.42 Favored 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 123.6 0.76 . . . . 0.0 111.181 -179.958 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -63.42 -56.13 18.71 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.48 0.712 . . . . 0.0 110.215 169.018 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -60.6 -37.85 82.75 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.475 0.71 . . . . 0.0 110.389 -176.423 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.41 -39.84 67.7 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 125.48 1.512 . . . . 0.0 113.759 170.039 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.1 m -61.08 -45.18 95.78 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 123.052 0.22 . . . . 0.0 110.445 171.873 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 32.0 mm-40 -63.86 -27.82 69.43 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-O 117.801 -1.095 . . . . 0.0 112.186 179.417 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 43.1 mm -56.33 -50.62 70.88 Favored 'Isoleucine or valine' 0 C--N 1.341 0.227 0 CA-C-N 120.106 1.321 . . . . 0.0 109.516 170.541 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 47.4 mm-40 -59.13 -56.08 26.75 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 107.218 -1.401 . . . . 0.0 107.218 -175.099 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 24.7 mttm -70.79 -30.67 67.2 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 118.366 -0.826 . . . . 0.0 111.317 -172.15 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 26.0 t -56.86 -46.97 81.44 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 168.571 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.2 -43.99 92.24 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.471 179.877 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -58.17 -46.95 84.84 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 119.434 1.015 . . . . 0.0 111.114 173.378 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.91 -14.8 56.45 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 176.152 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 56.8 m-80 -122.76 10.91 9.67 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.826 1.25 . . . . 0.0 111.439 -173.693 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.9 m 55.5 41.14 31.12 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 122.56 1.171 . . . . 0.0 110.817 177.758 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.255 6.5 m-85 71.85 12.86 6.15 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 128.544 2.738 . . . . 0.0 114.095 169.816 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 61.3 mtm -72.9 85.71 1.26 Allowed 'General case' 0 N--CA 1.437 -1.121 0 C-N-CA 125.323 1.449 . . . . 0.0 109.166 171.938 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -52.3 -25.66 10.1 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.214 1.006 . . . . 0.0 111.25 169.826 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.2 m -52.65 -36.7 57.24 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 127.145 2.178 . . . . 0.0 113.003 170.501 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 63.1 mttt -83.72 -40.85 18.34 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.588 0.755 . . . . 0.0 109.827 175.064 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 82.9 m -72.04 6.22 2.26 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.475 1.11 . . . . 0.0 113.341 179.433 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 67.7 mm-40 -56.29 -29.18 60.85 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 121.141 -0.974 . . . . 0.0 110.878 167.264 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.97 -55.03 37.7 Favored 'General case' 0 C--N 1.345 0.372 0 C-N-CA 125.285 1.434 . . . . 0.0 111.636 173.799 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.2 p -74.99 -28.75 21.33 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.677 0 C-N-CA 123.549 0.74 . . . . 0.0 109.742 -175.229 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 35.6 mt -61.55 -47.9 91.24 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 168.853 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -50.76 -40.74 55.61 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 123.597 0.56 . . . . 0.0 110.328 173.456 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -68.64 -39.98 80.49 Favored 'General case' 0 N--CA 1.434 -1.27 0 C-N-CA 119.996 -0.682 . . . . 0.0 111.065 -178.943 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.411 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.3 mt -66.06 -38.94 89.59 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 117.688 -1.149 . . . . 0.0 111.058 174.7 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 3.6 ptm180 -67.72 -40.11 84.24 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 120.019 1.281 . . . . 0.0 110.112 179.155 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt -63.22 -42.32 99.24 Favored 'General case' 0 C--N 1.342 0.282 0 C-N-CA 123.131 0.572 . . . . 0.0 110.377 176.191 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 51.8 t -58.04 -51.59 69.04 Favored 'General case' 0 C--O 1.218 -0.589 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 172.298 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.7 t -57.83 -46.09 85.22 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 123.765 0.826 . . . . 0.0 112.069 -173.167 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.67 -0.51 7.02 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.438 -0.801 . . . . 0.0 113.149 -177.782 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.527 ' HB3' ' CE2' ' A' ' 42' ' ' TYR . 17.9 tt0 -83.7 -9.7 58.67 Favored 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 123.722 0.809 . . . . 0.0 111.013 175.799 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.527 ' CE2' ' HB3' ' A' ' 41' ' ' GLN . 80.8 m-85 -139.08 160.4 62.74 Favored Pre-proline 0 N--CA 1.445 -0.724 0 C-N-CA 124.766 1.226 . . . . 0.0 111.725 -167.682 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -68.05 132.47 26.33 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 N-CA-C 105.956 -2.363 . . . . 0.0 105.956 165.758 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -50.27 -42.22 51.85 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.355 1.243 . . . . 0.0 114.355 -167.026 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.78 -11.63 31.03 Favored Glycine 0 CA--C 1.531 1.051 0 CA-C-O 119.081 -0.844 . . . . 0.0 113.555 -178.87 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.61 -19.43 65.77 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 118.916 1.358 . . . . 0.0 112.361 172.471 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.9 t -145.34 136.77 25.13 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-O 122.964 1.364 . . . . 0.0 111.912 -176.929 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.7 t -69.93 -54.24 19.99 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.635 0 CA-C-N 113.697 -1.592 . . . . 0.0 108.701 -179.701 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.6 m -61.34 -38.3 79.61 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 C-N-CA 122.668 0.387 . . . . 0.0 110.232 -179.2 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 11.2 t -66.6 -37.72 85.48 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.726 0.81 . . . . 0.0 109.751 177.354 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.5 m -64.82 -20.96 66.68 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 119.036 -0.507 . . . . 0.0 111.367 173.02 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -80.76 -23.67 59.53 Favored Glycine 0 C--N 1.345 1.031 0 CA-C-N 118.918 0.781 . . . . 0.0 112.3 169.161 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.411 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -80.88 -49.58 10.85 Favored 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 125.052 1.341 . . . . 0.0 114.04 -166.876 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 . . . . . 0 C--N 1.32 -0.684 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.549 176.105 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.1 t0 . . . . . 0 CA--C 1.536 0.418 0 CA-C-O 118.699 -0.667 . . . . 0.0 109.349 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -57.5 -32.72 94.95 Favored 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 124.09 3.193 . . . . 0.0 112.639 -175.594 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 95.3 m -94.23 -11.94 29.22 Favored 'General case' 0 N--CA 1.436 -1.15 0 C-N-CA 125.085 1.354 . . . . 0.0 113.497 -168.899 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 24.6 tp60 -62.5 -27.49 69.18 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 122.767 0.427 . . . . 0.0 110.602 178.224 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.45 -56.99 14.95 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.666 0.786 . . . . 0.0 108.92 169.579 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -64.01 -36.34 83.65 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 121.868 -0.52 . . . . 0.0 110.556 -176.722 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -60.24 -36.75 78.44 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.261 1.025 . . . . 0.0 112.472 172.619 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.6 m -65.72 -41.78 91.85 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 118.062 0.392 . . . . 0.0 111.031 169.248 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -62.61 -27.49 69.24 Favored 'General case' 0 C--O 1.226 -0.159 0 CA-C-O 117.639 -1.172 . . . . 0.0 112.159 177.907 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 46.2 mm -55.24 -52.37 46.03 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-N 120.098 1.317 . . . . 0.0 109.372 169.895 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 46.9 mm-40 -61.07 -49.75 76.1 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 -173.023 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.4 mtpm? -70.41 -37.37 74.43 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.236 1.014 . . . . 0.0 111.825 -176.015 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 12.9 t -54.27 -43.52 71.06 Favored 'General case' 0 CA--C 1.513 -0.458 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 170.134 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.94 -45.95 89.2 Favored 'General case' 0 N--CA 1.441 -0.909 0 O-C-N 123.57 0.544 . . . . 0.0 109.644 -178.075 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 -64.38 -41.75 96.51 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 119.138 0.881 . . . . 0.0 110.604 179.291 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.39 -11.24 14.51 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 171.833 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 55.2 m-80 -127.17 10.45 6.87 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.216 1.406 . . . . 0.0 112.105 -176.567 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 5.4 m 55.1 40.93 32.03 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 122.554 1.168 . . . . 0.0 111.859 -179.904 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.257 7.1 m-85 74.03 13.46 4.08 Favored 'General case' 0 N--CA 1.443 -0.796 0 C-N-CA 128.827 2.851 . . . . 0.0 114.371 168.464 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 67.5 mtm -70.07 84.3 0.52 Allowed 'General case' 0 N--CA 1.441 -0.909 0 C-N-CA 125.063 1.345 . . . . 0.0 109.708 170.248 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -54.26 -24.88 20.52 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.301 0.64 . . . . 0.0 111.499 172.809 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 8.4 t -56.69 -34.93 67.9 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.304 1.042 . . . . 0.0 112.42 172.656 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.9 mmtm -72.99 -46.17 53.76 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.997 0.919 . . . . 0.0 108.527 173.176 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 84.0 m -72.05 1.65 7.02 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 124.363 1.065 . . . . 0.0 113.035 -174.853 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 77.3 mm-40 -57.94 -23.85 55.34 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 120.02 1.282 . . . . 0.0 110.364 166.047 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.58 -56.55 20.76 Favored 'General case' 0 C--N 1.347 0.477 0 C-N-CA 126.043 1.737 . . . . 0.0 111.692 169.5 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.4 p -76.63 -26.23 16.43 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 C-N-CA 123.43 0.692 . . . . 0.0 109.932 -174.932 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 60.3 mt -61.52 -46.69 96.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 167.829 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -54.84 -38.98 68.09 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 119.291 0.951 . . . . 0.0 112.285 171.062 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -67.7 -39.43 84.38 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 118.771 0.714 . . . . 0.0 110.478 178.796 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.477 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -66.55 -27.08 67.47 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 124.932 1.293 . . . . 0.0 109.003 175.918 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 7.9 mmt-85 -70.79 -48.79 52.39 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 176.315 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 28.1 mmtp -60.91 -31.24 70.76 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 123.575 0.547 . . . . 0.0 111.363 177.834 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 43.1 t -67.06 -58.79 4.24 Favored 'General case' 0 N--CA 1.44 -0.964 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 168.455 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 38.8 t -61.52 -39.58 91.54 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 121.115 -0.991 . . . . 0.0 113.17 -169.173 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.47 -2.02 12.62 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 -175.605 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.535 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 12.1 tt0 -94.63 -7.21 41.54 Favored 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 127.43 2.292 . . . . 0.0 111.448 -171.086 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.535 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 78.4 m-85 -138.77 161.18 59.78 Favored Pre-proline 0 N--CA 1.447 -0.602 0 C-N-CA 124.445 1.098 . . . . 0.0 112.063 -167.877 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -67.79 121.03 8.05 Favored 'Trans proline' 0 N--CA 1.456 -0.713 0 N-CA-C 104.792 -2.811 . . . . 0.0 104.792 164.436 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.9 mmtt -51.35 -33.06 27.94 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 -166.025 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.88 -14.89 32.62 Favored Glycine 0 CA--C 1.533 1.18 0 C-N-CA 124.334 0.969 . . . . 0.0 113.913 176.313 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.9 tpm_? -57.12 -31.45 65.32 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 125.32 1.448 . . . . 0.0 111.247 169.446 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.6 t -136.64 134.8 37.71 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-O 123.372 1.558 . . . . 0.0 112.62 -168.781 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 15.6 t -68.91 -54.04 22.78 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.699 0 CA-C-N 112.789 -2.005 . . . . 0.0 108.425 177.044 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 5.1 m -60.72 -43.5 95.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.47 0 CA-C-O 118.241 -0.885 . . . . 0.0 109.814 -177.969 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 43.4 t -63.11 -32.05 73.34 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.427 1.491 . . . . 0.0 110.284 179.949 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.2 m -68.81 -27.72 66.11 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.059 0.544 . . . . 0.0 111.079 172.108 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.99 -35.17 78.22 Favored Glycine 0 C--N 1.345 1.031 0 CA-C-O 123.794 1.774 . . . . 0.0 111.525 167.357 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.477 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 1.5 t80 -80.78 -40.34 25.27 Favored 'General case' 0 N--CA 1.415 -2.216 0 N-CA-C 117.162 2.282 . . . . 0.0 117.162 -162.687 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 . . . . . 0 C--N 1.321 -0.634 0 CA-C-O 118.64 -0.695 . . . . 0.0 110.337 169.527 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.0 t0 . . . . . 0 N--CA 1.445 -0.723 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -59.04 -18.3 42.6 Favored 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 124.827 3.685 . . . . 0.0 115.053 -172.354 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 65.5 m -110.55 -8.49 14.63 Favored 'General case' 0 N--CA 1.438 -1.069 0 C-N-CA 126.888 2.075 . . . . 0.0 113.206 -168.473 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 18.5 tp60 -66.54 -23.97 66.3 Favored 'General case' 0 N--CA 1.445 -0.717 0 O-C-N 121.916 -0.49 . . . . 0.0 111.987 -173.258 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -69.07 -45.09 71.21 Favored 'General case' 0 C--O 1.225 -0.191 0 CA-C-O 121.827 0.822 . . . . 0.0 110.069 174.433 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.9 mp0 -65.74 -40.75 92.44 Favored 'General case' 0 N--CA 1.443 -0.807 0 C-N-CA 127.317 2.247 . . . . 0.0 108.098 -175.318 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.66 -44.43 73.28 Favored 'General case' 0 C--N 1.341 0.225 0 C-N-CA 125.474 1.51 . . . . 0.0 112.504 168.556 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 70.9 m -59.27 -43.87 92.47 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 110.424 -0.213 . . . . 0.0 110.424 175.399 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -63.96 -21.02 66.3 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 117.584 -1.198 . . . . 0.0 112.518 178.73 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 26.3 mm -59.75 -54.97 27.22 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.193 0 CA-C-N 120.587 1.54 . . . . 0.0 108.942 171.788 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -57.61 -54.25 49.03 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 115.163 -0.926 . . . . 0.0 108.848 178.343 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 57.2 mmtt -68.57 -30.64 69.45 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 118.567 -1.253 . . . . 0.0 111.592 -172.757 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 19.9 t -56.82 -48.85 77.05 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 168.789 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.76 -46.81 84.01 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 123.099 0.56 . . . . 0.0 110.477 179.55 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -57.22 -45.96 83.37 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.708 0.803 . . . . 0.0 111.267 174.204 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.85 -12.78 57.03 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 175.387 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -124.21 8.6 8.54 Favored 'General case' 0 C--N 1.342 0.264 0 C-N-CA 124.592 1.157 . . . . 0.0 112.29 -172.524 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 58.6 40.1 23.96 Favored 'General case' 0 C--N 1.345 0.389 0 CA-C-O 122.414 1.102 . . . . 0.0 110.846 179.42 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.264 7.1 m-85 72.09 13.88 5.77 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 127.849 2.459 . . . . 0.0 114.612 168.72 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 66.0 mtm -69.83 85.84 0.5 Allowed 'General case' 0 N--CA 1.441 -0.91 0 C-N-CA 125.063 1.345 . . . . 0.0 110.107 170.148 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -53.9 -24.47 16.24 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.505 0.722 . . . . 0.0 111.698 170.643 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.1 m -53.65 -40.56 65.97 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 126.299 1.839 . . . . 0.0 112.335 170.631 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.4 mmtm -71.85 -47.28 54.15 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 124.201 1.0 . . . . 0.0 108.754 174.132 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 70.9 m -74.22 4.29 5.93 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 124.78 1.232 . . . . 0.0 113.418 -173.626 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 59.4 mm-40 -54.9 -32.29 60.89 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 119.131 0.878 . . . . 0.0 109.894 166.846 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.96 -53.0 63.0 Favored 'General case' 0 C--N 1.345 0.39 0 C-N-CA 124.582 1.153 . . . . 0.0 111.676 174.709 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.7 p -77.54 -27.15 15.46 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.78 0 C-N-CA 123.439 0.696 . . . . 0.0 110.027 -174.296 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 53.7 mt -63.18 -44.03 99.13 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 168.581 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -57.92 -29.74 65.37 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 118.966 0.803 . . . . 0.0 111.768 173.193 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -70.17 -47.5 61.34 Favored 'General case' 0 N--CA 1.443 -0.822 0 CA-C-N 118.69 0.677 . . . . 0.0 111.557 173.458 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.7 mt -61.9 -31.6 71.91 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 118.958 0.799 . . . . 0.0 110.239 176.759 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.73 -59.72 4.96 Favored 'General case' 0 CA--C 1.52 -0.208 0 C-N-CA 125.948 1.699 . . . . 0.0 109.956 175.2 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -63.47 -34.79 78.55 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 114.715 -1.13 . . . . 0.0 110.922 -177.256 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 42.8 t -62.22 -51.64 66.97 Favored 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 169.726 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 52.5 t -64.36 -48.73 74.41 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 123.7 0.8 . . . . 0.0 112.003 -170.173 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.85 -1.3 5.28 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 124.216 1.006 . . . . 0.0 112.339 -175.707 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.447 ' HB3' ' CE2' ' A' ' 42' ' ' TYR . 2.2 tp-100 -81.32 -8.22 59.71 Favored 'General case' 0 N--CA 1.437 -1.085 0 C-N-CA 125.005 1.322 . . . . 0.0 111.288 175.033 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.447 ' CE2' ' HB3' ' A' ' 41' ' ' GLN . 82.0 m-85 -142.04 160.4 55.52 Favored Pre-proline 0 N--CA 1.443 -0.818 0 C-N-CA 125.015 1.326 . . . . 0.0 111.907 -167.438 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -69.37 124.95 11.76 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 N-CA-C 105.641 -2.484 . . . . 0.0 105.641 165.234 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -47.11 -35.75 7.5 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 116.205 1.928 . . . . 0.0 116.205 -166.947 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.9 -14.56 17.06 Favored Glycine 0 CA--C 1.534 1.265 0 C-N-CA 124.515 1.055 . . . . 0.0 114.051 177.946 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 9.0 tpm_? -54.83 -28.46 49.82 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 126.401 1.88 . . . . 0.0 112.348 168.62 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.0 t -149.69 140.37 22.61 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-O 122.623 1.202 . . . . 0.0 111.531 -168.968 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 10.5 t -69.47 -54.24 20.67 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.691 0 CA-C-N 114.019 -1.446 . . . . 0.0 108.617 178.028 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.5 m -61.07 -40.49 85.85 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 C-N-CA 122.916 0.486 . . . . 0.0 110.334 -177.542 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 12.6 t -67.1 -36.04 81.07 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.716 1.206 . . . . 0.0 109.905 177.473 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 53.3 m -65.51 -27.59 68.58 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 121.773 -0.579 . . . . 0.0 110.873 172.476 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -71.14 -27.91 71.12 Favored Glycine 0 C--N 1.345 1.047 0 CA-C-O 122.125 0.847 . . . . 0.0 112.06 169.425 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -80.95 -47.66 13.37 Favored 'General case' 0 N--CA 1.428 -1.574 0 C-N-CA 125.727 1.611 . . . . 0.0 114.801 -166.965 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 . . . . . 0 CA--C 1.54 0.593 0 C-N-CA 119.517 -0.873 . . . . 0.0 110.152 173.626 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 36.6 t0 . . . . . 0 CA--C 1.537 0.464 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_exo -60.57 -31.34 92.18 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 123.599 2.866 . . . . 0.0 112.781 -171.809 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 77.7 m -94.25 -13.17 26.82 Favored 'General case' 0 N--CA 1.438 -1.069 0 C-N-CA 125.194 1.398 . . . . 0.0 112.558 -169.45 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.0 tp60 -61.7 -25.23 67.29 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 123.131 0.572 . . . . 0.0 110.855 177.804 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.8 tttm -60.14 -56.58 19.83 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.824 1.25 . . . . 0.0 109.962 168.118 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -62.99 -36.97 85.3 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.355 0.662 . . . . 0.0 110.568 -177.992 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.63 -43.95 72.75 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 124.854 1.262 . . . . 0.0 112.214 169.388 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 80.8 m -57.93 -43.5 86.32 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 121.174 -0.21 . . . . 0.0 110.965 172.96 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -63.61 -23.56 67.43 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-O 117.751 -1.119 . . . . 0.0 112.491 178.728 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 26.4 mm -59.36 -54.72 30.39 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.226 0 CA-C-N 120.128 1.331 . . . . 0.0 108.833 172.531 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 33.0 mm-40 -59.2 -53.07 62.49 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.422 179.467 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.34 -33.08 74.93 Favored 'General case' 0 C--N 1.333 -0.111 0 C-N-CA 118.703 -1.199 . . . . 0.0 111.568 -175.811 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 23.6 t -56.1 -47.68 77.59 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 119.271 0.941 . . . . 0.0 108.944 169.329 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.07 -46.83 84.78 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 123.516 0.727 . . . . 0.0 110.682 178.8 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -57.4 -43.83 84.05 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.72 0.808 . . . . 0.0 111.305 173.782 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.5 -11.96 59.19 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.076 0.95 . . . . 0.0 113.477 174.631 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 -125.66 8.63 7.62 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 124.719 1.208 . . . . 0.0 112.358 -172.029 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.1 m 58.56 40.17 24.0 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-N 119.494 1.043 . . . . 0.0 110.903 179.78 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.257 6.9 m-85 71.71 13.34 6.24 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 127.654 2.382 . . . . 0.0 114.779 168.614 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 64.4 mtm -70.17 84.61 0.54 Allowed 'General case' 0 N--CA 1.441 -0.892 0 C-N-CA 125.184 1.394 . . . . 0.0 109.722 170.082 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -54.63 -24.27 20.78 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 119.063 -0.494 . . . . 0.0 111.637 172.335 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.8 m -51.77 -44.05 63.22 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 126.452 1.901 . . . . 0.0 112.141 170.076 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.4 mmtm -67.75 -48.49 66.26 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 124.175 0.99 . . . . 0.0 108.687 174.651 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.2 m -72.73 2.71 6.1 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 124.973 1.309 . . . . 0.0 113.302 -174.748 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 45.9 mm-40 -56.3 -26.64 52.82 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 120.078 1.308 . . . . 0.0 111.281 168.159 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.34 -51.38 69.64 Favored 'General case' 0 C--N 1.345 0.392 0 C-N-CA 125.537 1.535 . . . . 0.0 112.184 169.951 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.7 p -80.71 -26.09 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.888 0 C-N-CA 123.698 0.799 . . . . 0.0 109.657 -174.759 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.5 mp -60.51 -48.52 88.15 Favored 'Isoleucine or valine' 0 C--N 1.35 0.593 0 N-CA-C 105.689 -1.967 . . . . 0.0 105.689 166.214 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.98 -37.63 61.48 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 123.212 0.605 . . . . 0.0 110.886 176.514 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -70.91 -39.49 72.69 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 120.072 -0.651 . . . . 0.0 110.974 179.669 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.454 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.0 OUTLIER -64.4 -36.83 85.41 Favored 'General case' 0 C--N 1.342 0.279 0 CA-C-O 117.877 -1.059 . . . . 0.0 110.765 174.663 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.12 -40.5 82.51 Favored 'General case' 0 C--N 1.341 0.219 0 CA-C-N 119.775 1.17 . . . . 0.0 110.215 178.347 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 57.2 mttp -63.49 -39.55 94.73 Favored 'General case' 0 C--N 1.341 0.218 0 CA-C-O 119.232 -0.413 . . . . 0.0 111.012 175.536 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.1 t -59.33 -52.74 64.34 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 171.937 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.1 t -57.74 -48.87 78.4 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 124.034 0.934 . . . . 0.0 112.048 -171.663 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.12 -1.25 7.26 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.241 -0.89 . . . . 0.0 112.722 -175.148 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.509 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 21.2 tt0 -84.15 -12.09 55.52 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 125.203 1.401 . . . . 0.0 111.345 179.088 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.509 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 76.4 m-85 -133.02 157.87 77.26 Favored Pre-proline 0 N--CA 1.447 -0.617 0 C-N-CA 124.174 0.99 . . . . 0.0 112.003 -168.146 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -67.31 109.43 1.78 Allowed 'Trans proline' 0 N--CA 1.453 -0.898 0 N-CA-C 104.878 -2.778 . . . . 0.0 104.878 165.501 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.88 -27.48 0.53 Allowed 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 117.199 2.296 . . . . 0.0 117.199 -166.773 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.47 -18.44 29.92 Favored Glycine 0 CA--C 1.536 1.369 0 CA-C-N 119.512 1.051 . . . . 0.0 113.571 172.479 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.26 -21.19 63.67 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.946 2.098 . . . . 0.0 112.516 170.93 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.6 t -148.06 134.59 19.75 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 123.566 1.651 . . . . 0.0 114.152 -170.434 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.8 t -72.43 -55.33 13.52 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.638 0 CA-C-N 112.552 -2.113 . . . . 0.0 108.886 178.017 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 5.9 m -59.2 -40.88 82.21 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 C-N-CA 122.684 0.394 . . . . 0.0 110.029 -179.178 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 13.3 t -63.78 -37.57 87.88 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.524 1.13 . . . . 0.0 109.713 178.021 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 52.7 m -67.64 -17.11 64.49 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 118.727 -0.654 . . . . 0.0 112.319 175.035 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -86.04 -20.57 55.1 Favored Glycine 0 C--N 1.344 0.991 0 CA-C-N 119.148 0.886 . . . . 0.0 112.205 167.776 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.454 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -80.21 -43.13 22.0 Favored 'General case' 0 N--CA 1.418 -2.052 0 N-CA-C 113.959 1.096 . . . . 0.0 113.959 -166.269 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 . . . . . 0 C--N 1.319 -0.752 0 O-C-N 123.975 0.797 . . . . 0.0 110.68 179.916 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 46.1 t0 . . . . . 0 CA--C 1.539 0.524 0 CA-C-O 119.183 -0.437 . . . . 0.0 111.814 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -63.85 -28.42 67.51 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 123.646 2.897 . . . . 0.0 112.671 -175.509 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 13.1 m -91.44 -8.1 48.75 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 123.418 0.687 . . . . 0.0 112.145 -176.927 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 20.1 tp60 -63.48 -25.04 68.08 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 119.13 0.877 . . . . 0.0 110.527 -179.514 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -60.04 -52.32 65.89 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.506 1.122 . . . . 0.0 109.589 169.454 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -65.37 -38.71 90.89 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.616 -0.678 . . . . 0.0 110.244 -179.442 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -59.97 -35.4 74.92 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.136 0.974 . . . . 0.0 112.522 172.329 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 95.6 m -65.13 -43.55 91.55 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.229 0.468 . . . . 0.0 110.936 169.207 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 -62.75 -25.54 68.25 Favored 'General case' 0 C--O 1.225 -0.232 0 CA-C-O 117.725 -1.131 . . . . 0.0 112.221 178.367 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 45.2 mm -56.72 -50.3 74.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-N 120.187 1.358 . . . . 0.0 109.439 169.56 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 44.9 mm-40 -60.68 -54.32 46.74 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 -175.729 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 27.0 mttm -70.53 -30.92 67.8 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 118.56 -0.733 . . . . 0.0 111.623 -173.29 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 21.5 t -56.98 -46.0 82.52 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 107.934 -1.136 . . . . 0.0 107.934 168.666 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.0 -43.9 91.58 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-O 118.297 -0.859 . . . . 0.0 110.372 179.722 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -58.51 -46.51 86.6 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 119.475 1.034 . . . . 0.0 111.129 173.07 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.42 -15.28 60.3 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 175.953 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.3 m-80 -122.81 11.05 9.65 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.925 1.29 . . . . 0.0 111.43 -172.931 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.9 m 55.98 40.74 30.36 Favored 'General case' 0 C--N 1.346 0.44 0 CA-C-O 122.556 1.17 . . . . 0.0 110.817 177.315 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.253 6.7 m-85 71.85 12.59 6.17 Favored 'General case' 0 N--CA 1.444 -0.758 0 C-N-CA 128.466 2.706 . . . . 0.0 114.068 169.713 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 62.0 mtm -73.26 83.99 1.38 Allowed 'General case' 0 N--CA 1.437 -1.123 0 C-N-CA 125.445 1.498 . . . . 0.0 109.159 172.214 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -53.46 -24.01 11.68 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.022 0.929 . . . . 0.0 111.465 172.115 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.1 m -51.88 -41.29 61.78 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 126.131 1.773 . . . . 0.0 112.307 169.988 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 56.8 mttt -76.69 -42.5 41.35 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.234 0.614 . . . . 0.0 109.753 175.779 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.8 m -70.98 0.73 6.79 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 124.193 0.997 . . . . 0.0 113.275 -178.7 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 82.3 mm-40 -55.25 -27.44 46.44 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 119.935 1.243 . . . . 0.0 110.823 167.114 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.07 -60.57 3.54 Favored 'General case' 0 C--N 1.345 0.401 0 C-N-CA 125.637 1.575 . . . . 0.0 111.467 171.46 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.6 p -70.93 -29.46 37.38 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.694 0 C-N-CA 123.635 0.774 . . . . 0.0 109.979 -174.437 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 70.3 mt -58.63 -52.7 56.66 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 N-CA-C 105.869 -1.9 . . . . 0.0 105.869 168.842 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -58.79 -30.07 67.3 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 119.48 1.036 . . . . 0.0 113.187 175.921 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -71.27 -37.67 71.89 Favored 'General case' 0 N--CA 1.438 -1.072 0 C-N-CA 119.833 -0.747 . . . . 0.0 109.724 176.62 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.42 -30.74 71.82 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 124.811 1.244 . . . . 0.0 108.916 172.289 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.2 mmt85 -70.35 -49.58 47.84 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 -179.952 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 46.1 mttp -61.71 -36.57 81.29 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 124.257 1.023 . . . . 0.0 111.156 177.13 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 42.7 t -60.45 -54.04 50.27 Favored 'General case' 0 C--O 1.221 -0.429 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 169.357 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 51.5 t -61.49 -44.27 97.39 Favored 'General case' 0 CA--C 1.515 -0.379 0 C-N-CA 124.477 1.111 . . . . 0.0 112.202 -169.6 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.45 -3.14 16.31 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.18 -0.918 . . . . 0.0 113.112 -178.354 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.423 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 2.5 tp-100 -88.63 -2.48 58.62 Favored 'General case' 0 N--CA 1.439 -0.999 0 C-N-CA 124.219 1.008 . . . . 0.0 111.361 -175.783 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.423 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 63.2 m-85 -143.13 162.88 40.83 Favored Pre-proline 0 N--CA 1.443 -0.804 0 C-N-CA 127.364 2.266 . . . . 0.0 110.795 -168.882 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_exo -61.33 116.97 3.74 Favored 'Trans proline' 0 N--CA 1.456 -0.699 0 N-CA-C 105.706 -2.459 . . . . 0.0 105.706 166.231 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -51.84 -35.36 44.31 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 120.498 1.499 . . . . 0.0 114.655 -168.929 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -70.26 -4.61 51.13 Favored Glycine 0 CA--C 1.531 1.089 0 CA-C-O 118.258 -1.301 . . . . 0.0 114.143 178.395 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.97 -7.18 32.78 Favored 'General case' 0 CA--C 1.554 1.104 0 CA-C-N 120.044 1.922 . . . . 0.0 111.86 174.508 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.7 t -141.17 155.32 46.09 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 126.162 1.785 . . . . 0.0 110.404 -168.392 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 47.9 t -79.2 -60.92 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.562 0 C-N-CA 124.876 1.27 . . . . 0.0 108.801 171.197 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.5 m -60.37 -44.31 95.71 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 CA-C-O 119.073 -0.489 . . . . 0.0 110.044 -169.631 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 31.7 t -65.64 -29.39 69.96 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.177 1.391 . . . . 0.0 110.23 -179.737 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 69.6 m -69.68 -21.62 63.5 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 118.533 -0.746 . . . . 0.0 111.307 171.796 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -75.51 -39.23 35.82 Favored Glycine 0 C--N 1.344 1.009 0 CA-C-O 124.474 2.152 . . . . 0.0 110.681 166.976 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -76.69 -38.73 53.94 Favored 'General case' 0 N--CA 1.419 -1.998 0 CA-C-N 111.819 -2.19 . . . . 0.0 116.705 -163.721 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 . . . . . 0 C--N 1.322 -0.6 0 CA-C-O 118.643 -0.694 . . . . 0.0 110.954 169.731 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.5 mtt . . . . . 0 CA--C 1.54 0.584 0 N-CA-C 111.705 0.261 . . . . 0.0 111.705 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -76.45 60.47 6.48 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 123.961 3.107 . . . . 0.0 109.491 169.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 30.8 mm-40 -143.75 -176.26 4.91 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 129.125 2.97 . . . . 0.0 107.856 -174.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -57.52 114.28 2.16 Favored 'General case' 0 C--N 1.341 0.235 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 169.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 36.0 t0 -95.13 105.92 22.53 Favored Pre-proline 0 N--CA 1.446 -0.647 0 C-N-CA 127.428 2.291 . . . . 0.0 107.776 -176.261 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -55.91 -33.93 90.28 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 124.499 3.466 . . . . 0.0 113.068 -175.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 56.8 m -94.92 -13.2 25.61 Favored 'General case' 0 N--CA 1.435 -1.217 0 C-N-CA 125.815 1.646 . . . . 0.0 113.054 -169.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.6 tp60 -62.64 -25.94 68.37 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.695 0.68 . . . . 0.0 111.416 -177.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -61.21 -50.44 73.07 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.376 0.67 . . . . 0.0 110.195 172.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -64.47 -44.59 90.56 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 123.777 0.831 . . . . 0.0 109.149 179.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.59 -41.53 54.74 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 119.937 1.244 . . . . 0.0 113.035 174.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 84.6 m -56.56 -46.7 80.58 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 123.419 0.449 . . . . 0.0 110.128 174.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -60.28 -39.04 85.48 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 117.496 -1.24 . . . . 0.0 112.303 177.116 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 2.0 mp -59.16 -49.87 81.82 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 CA-C-N 120.451 1.478 . . . . 0.0 109.482 173.281 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 93.8 mm-40 -61.34 -51.35 69.18 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 -174.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 41.2 mtpt -68.89 -37.98 79.34 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 123.798 0.839 . . . . 0.0 111.945 -177.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 17.2 t -52.28 -46.45 65.87 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 169.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.57 -46.39 84.02 Favored 'General case' 0 N--CA 1.442 -0.856 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 -177.075 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -63.15 -44.2 96.2 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 118.999 0.818 . . . . 0.0 110.637 179.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -60.95 -14.11 20.49 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 113.193 0.812 . . . . 0.0 113.193 172.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 57.9 m-80 -122.34 11.51 10.04 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.59 1.556 . . . . 0.0 111.123 -177.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 12.6 m 51.6 43.31 29.86 Favored 'General case' 0 C--N 1.346 0.447 0 C-N-CA 125.026 1.33 . . . . 0.0 112.011 -179.256 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.271 7.4 m-85 73.49 14.26 4.38 Favored 'General case' 0 N--CA 1.441 -0.891 0 C-N-CA 129.14 2.976 . . . . 0.0 113.976 169.145 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 64.7 mtm -69.88 85.03 0.49 Allowed 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 125.37 1.468 . . . . 0.0 110.351 170.057 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -55.33 -17.6 5.04 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 127.115 2.166 . . . . 0.0 111.179 168.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 68.8 m -60.75 -54.06 49.86 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.76 1.624 . . . . 0.0 110.346 168.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 57.6 mttt -67.3 -43.29 82.07 Favored 'General case' 0 C--O 1.231 0.128 0 O-C-N 121.799 -0.563 . . . . 0.0 109.846 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.5 m -71.09 2.69 4.19 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 117.234 -1.365 . . . . 0.0 113.164 175.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 59.0 mm-40 -53.6 -34.24 57.73 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 121.022 1.737 . . . . 0.0 111.432 169.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.08 -56.42 22.49 Favored 'General case' 0 C--N 1.342 0.271 0 CA-C-N 119.271 0.941 . . . . 0.0 111.308 177.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.9 p -73.21 -33.22 40.99 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.025 -174.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 35.9 mt -59.25 -44.05 91.18 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.467 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 170.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.45 HE22 ' NH1' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -54.54 -34.71 62.24 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 118.332 0.515 . . . . 0.0 111.172 173.962 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -72.09 -40.17 68.41 Favored 'General case' 0 N--CA 1.427 -1.581 0 C-N-CA 118.536 -1.266 . . . . 0.0 111.158 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.5 mt -65.01 -30.5 71.49 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 119.903 1.229 . . . . 0.0 111.75 173.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.45 ' NH1' HE22 ' A' ' 33' ' ' GLN . 0.3 OUTLIER -59.95 -58.23 9.46 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 124.053 0.941 . . . . 0.0 108.879 174.735 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.48 -35.62 76.34 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 114.15 -1.386 . . . . 0.0 111.11 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 49.6 t -62.27 -50.11 72.99 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 123.52 0.728 . . . . 0.0 109.288 172.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 53.1 t -64.05 -48.07 77.72 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 123.905 0.882 . . . . 0.0 111.671 -172.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.44 ' HA ' ' HE3' ' A' ' 44' ' ' LYS . . . -67.45 -2.98 7.21 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 124.434 1.093 . . . . 0.0 112.706 -178.167 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.412 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 2.6 tp-100 -83.5 -5.87 59.29 Favored 'General case' 0 N--CA 1.439 -1.015 0 C-N-CA 124.87 1.268 . . . . 0.0 111.414 179.096 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.412 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 82.6 m-85 -138.81 161.83 56.15 Favored Pre-proline 0 N--CA 1.444 -0.767 0 C-N-CA 125.415 1.486 . . . . 0.0 110.508 -169.045 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -67.73 107.95 1.56 Allowed 'Trans proline' 0 N--CA 1.457 -0.664 0 N-CA-C 104.518 -2.916 . . . . 0.0 104.518 165.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.44 ' HE3' ' HA ' ' A' ' 40' ' ' ALA . 31.6 mmtm -38.08 -43.29 0.73 Allowed 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 117.04 2.237 . . . . 0.0 117.04 -163.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.19 -14.33 11.54 Favored Glycine 0 CA--C 1.537 1.429 0 C-N-CA 124.475 1.036 . . . . 0.0 114.109 177.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 29.1 tpt85 -48.83 -34.11 11.81 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 128.285 2.634 . . . . 0.0 112.168 170.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.3 t -138.78 140.86 38.76 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-O 121.939 0.876 . . . . 0.0 110.301 -169.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 11.8 t -69.52 -53.29 25.52 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 CA-C-N 114.413 -1.267 . . . . 0.0 108.823 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 5.0 m -61.88 -38.9 81.71 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 CA-C-O 119.297 -0.382 . . . . 0.0 110.248 -178.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 10.2 t -66.27 -38.31 87.51 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.915 0.886 . . . . 0.0 109.799 176.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.4 m -65.24 -21.07 66.69 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 118.803 -0.618 . . . . 0.0 111.309 173.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -79.01 -25.97 58.95 Favored Glycine 0 C--N 1.343 0.958 0 CA-C-O 122.173 0.874 . . . . 0.0 112.34 168.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -80.41 -44.85 18.65 Favored 'General case' 0 N--CA 1.429 -1.503 0 N-CA-C 114.85 1.426 . . . . 0.0 114.85 -165.642 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -64.19 -24.12 67.56 Favored 'General case' 0 C--N 1.319 -0.744 0 O-C-N 123.546 0.528 . . . . 0.0 110.425 173.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -73.43 -43.27 60.75 Favored 'General case' 0 C--N 1.346 0.422 0 O-C-N 121.398 -0.814 . . . . 0.0 110.217 168.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.45 -40.94 88.44 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.547 0.739 . . . . 0.0 110.901 175.06 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -59.79 -49.26 78.42 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 125.383 1.473 . . . . 0.0 109.257 175.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -56.3 -47.74 78.06 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-O 118.068 -0.968 . . . . 0.0 110.027 172.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -55.05 -48.4 73.5 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 119.308 0.958 . . . . 0.0 110.851 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -66.32 -30.53 70.96 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.009 0.924 . . . . 0.0 111.371 -178.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 39.5 mt -78.22 -42.47 31.21 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.823 1.249 . . . . 0.0 109.065 -179.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -56.84 -42.64 80.02 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.887 1.675 . . . . 0.0 109.95 169.117 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 39.6 ttp180 -70.48 -17.38 62.97 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.95 1.3 . . . . 0.0 112.256 176.328 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 55.19 24.94 6.72 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 128.203 2.601 . . . . 0.0 113.22 169.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 64.0 p -168.08 160.86 12.23 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 123.777 0.831 . . . . 0.0 110.531 -169.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -78.5 27.63 0.21 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.216 1.407 . . . . 0.0 112.512 169.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 43.1 m -64.08 177.9 0.74 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.758 1.623 . . . . 0.0 111.07 175.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 64.5 tttm . . . . . 0 C--N 1.343 0.313 0 C-N-CA 124.057 0.943 . . . . 0.0 108.994 -170.098 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.3 ptm . . . . . 0 N--CA 1.445 -0.711 0 CA-C-O 118.375 -0.821 . . . . 0.0 108.904 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -67.08 110.41 1.96 Allowed 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 122.41 2.073 . . . . 0.0 108.411 168.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.432 ' C ' ' H ' ' A' ' 5' ' ' ASP . 78.0 mt-30 -74.59 172.33 12.23 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.107 0.963 . . . . 0.0 110.059 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 43.9 tttm -68.78 30.79 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.529 1.932 . . . . 0.0 112.515 171.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.432 ' H ' ' C ' ' A' ' 3' ' ' GLN . 27.2 t0 -97.73 103.71 17.99 Favored Pre-proline 0 N--CA 1.444 -0.744 0 C-N-CA 128.361 2.664 . . . . 0.0 109.245 -171.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -55.94 -29.44 73.23 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 123.68 2.92 . . . . 0.0 113.572 -176.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 99.1 m -102.27 -8.78 20.97 Favored 'General case' 0 N--CA 1.438 -1.057 0 C-N-CA 125.857 1.663 . . . . 0.0 113.974 -168.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.1 tt0 -62.96 -26.0 68.63 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 123.454 0.702 . . . . 0.0 111.327 -179.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.9 tmtt? -61.34 -53.23 59.34 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.45 1.1 . . . . 0.0 109.977 169.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -63.61 -43.96 95.38 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.714 0.806 . . . . 0.0 109.866 -178.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -51.05 -42.03 60.26 Favored 'General case' 0 C--N 1.341 0.217 0 C-N-CA 125.227 1.411 . . . . 0.0 112.773 169.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 79.7 m -63.23 -43.53 97.82 Favored 'General case' 0 C--O 1.234 0.239 0 O-C-N 123.166 0.291 . . . . 0.0 111.114 174.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 57.1 mm-40 -59.52 -32.93 70.75 Favored 'General case' 0 C--N 1.342 0.28 0 CA-C-O 118.325 -0.845 . . . . 0.0 111.529 177.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 10.6 mm -58.42 -44.63 89.12 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.143 0 CA-C-N 119.519 1.054 . . . . 0.0 110.561 174.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 63.8 mm-40 -64.68 -51.13 64.11 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 -169.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.0 tmtt? -67.52 -39.54 85.1 Favored 'General case' 0 N--CA 1.442 -0.862 0 C-N-CA 127.536 2.334 . . . . 0.0 111.407 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 15.3 t -52.37 -44.97 65.58 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 170.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.8 -44.88 93.74 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-O 118.826 -0.607 . . . . 0.0 109.951 -178.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 -65.44 -41.34 93.58 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 119.243 0.928 . . . . 0.0 110.65 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.75 -11.87 14.21 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.069 0.948 . . . . 0.0 113.102 171.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 57.8 m-80 -125.35 10.09 7.95 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.085 1.354 . . . . 0.0 112.142 -176.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 13.1 m 53.43 42.36 32.0 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-O 122.723 1.249 . . . . 0.0 112.003 -178.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.259 6.5 m-85 73.34 13.26 4.66 Favored 'General case' 0 N--CA 1.444 -0.749 0 C-N-CA 128.431 2.692 . . . . 0.0 114.486 168.504 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 68.7 mtm -69.86 84.8 0.49 Allowed 'General case' 0 N--CA 1.441 -0.922 0 C-N-CA 124.876 1.27 . . . . 0.0 109.725 169.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -53.34 -25.1 13.83 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.828 0.851 . . . . 0.0 111.337 170.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.5 m -51.16 -40.47 58.67 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 126.631 1.972 . . . . 0.0 112.587 170.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 54.2 mmtt -74.52 -47.9 30.24 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.358 1.063 . . . . 0.0 108.8 175.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 82.3 m -71.65 3.21 4.22 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.905 1.282 . . . . 0.0 113.224 -176.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 41.3 mm-40 -54.8 -32.9 60.81 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 119.488 1.04 . . . . 0.0 110.151 167.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.99 -58.89 6.17 Favored 'General case' 0 C--N 1.345 0.408 0 C-N-CA 124.977 1.311 . . . . 0.0 111.333 175.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 10.6 p -69.85 -32.27 51.27 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 C-N-CA 124.013 0.925 . . . . 0.0 109.761 -174.206 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 72.4 mt -60.42 -48.28 89.02 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 N-CA-C 107.106 -1.442 . . . . 0.0 107.106 170.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.426 HE22 ' NH1' ' A' ' 36' ' ' ARG . 1.6 tp-100 -59.26 -20.39 53.84 Favored 'General case' 0 N--CA 1.439 -0.976 0 O-C-N 121.08 -1.013 . . . . 0.0 112.692 175.589 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.3 tp10 -80.36 -34.93 36.13 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 120.366 1.439 . . . . 0.0 111.83 169.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.9 mt -58.82 -27.13 64.8 Favored 'General case' 0 C--N 1.345 0.399 0 CA-C-N 120.298 1.408 . . . . 0.0 109.456 172.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.426 ' NH1' HE22 ' A' ' 33' ' ' GLN . 18.3 mmt85 -64.17 -52.22 60.02 Favored 'General case' 0 CA--C 1.52 -0.206 0 C-N-CA 123.915 0.886 . . . . 0.0 109.487 176.362 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -67.99 -28.09 67.13 Favored 'General case' 0 C--O 1.235 0.304 0 O-C-N 123.572 0.545 . . . . 0.0 111.036 -177.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 49.8 t -68.11 -53.0 28.59 Favored 'General case' 0 N--CA 1.438 -1.041 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 168.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 51.8 t -64.12 -50.53 67.9 Favored 'General case' 0 CA--C 1.515 -0.389 0 C-N-CA 124.33 1.052 . . . . 0.0 112.381 -169.332 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.93 0.95 3.81 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.708 0.803 . . . . 0.0 112.613 -173.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.539 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 9.5 tt0 -82.82 -11.17 58.45 Favored 'General case' 0 N--CA 1.439 -1.008 0 C-N-CA 126.721 2.008 . . . . 0.0 110.855 176.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.539 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 77.1 m-85 -139.92 162.02 52.79 Favored Pre-proline 0 N--CA 1.445 -0.677 0 C-N-CA 125.125 1.37 . . . . 0.0 111.877 -168.093 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.43 144.77 46.22 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 N-CA-C 107.692 -1.696 . . . . 0.0 107.692 166.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 55.3 tttp -52.23 -40.73 62.02 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 114.189 1.181 . . . . 0.0 114.189 -170.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -64.92 -7.63 30.81 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 124.016 0.817 . . . . 0.0 113.604 -179.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.3 tpm_? -70.33 -21.16 62.94 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 118.957 1.379 . . . . 0.0 111.61 172.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.8 t -150.69 135.18 17.17 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-O 122.982 1.372 . . . . 0.0 112.867 -169.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 13.4 t -67.43 -52.57 40.4 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 CA-C-N 113.39 -1.732 . . . . 0.0 108.449 175.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 3.1 m -64.28 -41.82 93.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 CA-C-O 118.321 -0.847 . . . . 0.0 109.923 -176.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 43.9 t -64.53 -30.51 71.53 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.708 1.603 . . . . 0.0 110.019 177.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 48.9 m -67.01 -32.37 73.56 Favored 'General case' 0 CA--C 1.536 0.41 0 O-C-N 121.682 -0.636 . . . . 0.0 110.903 170.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.51 -33.36 84.44 Favored Glycine 0 C--N 1.344 0.985 0 CA-C-O 123.033 1.352 . . . . 0.0 111.397 168.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -81.03 -45.35 16.69 Favored 'General case' 0 N--CA 1.423 -1.812 0 N-CA-C 115.785 1.772 . . . . 0.0 115.785 -165.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -62.87 -27.55 69.43 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 119.121 -0.466 . . . . 0.0 110.219 169.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 58.9 tptt -70.22 -39.54 75.07 Favored 'General case' 0 C--N 1.347 0.495 0 CA-C-N 119.025 0.83 . . . . 0.0 110.526 168.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -59.15 -41.67 88.89 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 118.846 0.748 . . . . 0.0 110.501 171.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -65.33 -40.64 93.96 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.161 0.984 . . . . 0.0 110.326 178.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -59.84 -43.04 94.81 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 118.228 0.467 . . . . 0.0 110.615 170.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -59.77 -38.87 83.04 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.234 0.614 . . . . 0.0 111.437 172.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -64.91 -34.84 79.35 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 117.975 -1.012 . . . . 0.0 111.142 178.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 92.0 mt -64.2 -14.91 58.49 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 118.787 0.721 . . . . 0.0 112.611 171.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 19.5 p -85.47 -48.95 8.48 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 119.909 1.231 . . . . 0.0 109.85 169.001 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 31.8 ttp180 -58.69 -66.21 0.53 Allowed 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 125.973 1.709 . . . . 0.0 110.368 -178.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -83.06 77.33 9.76 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 103.647 -2.723 . . . . 0.0 103.647 168.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 5.1 m -51.97 129.12 26.28 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 114.101 1.148 . . . . 0.0 114.101 -166.085 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -167.34 -161.87 0.43 Allowed 'General case' 0 N--CA 1.444 -0.736 0 C-N-CA 129.901 3.281 . . . . 0.0 106.478 -169.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 51.4 m -156.25 169.99 23.28 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 124.646 1.178 . . . . 0.0 108.672 168.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 58.6 tptt . . . . . 0 CA--C 1.53 0.183 0 C-N-CA 124.419 1.088 . . . . 0.0 110.596 -175.01 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.644 0 CA-C-O 119.214 -0.422 . . . . 0.0 111.343 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -64.87 119.38 6.4 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 123.512 2.808 . . . . 0.0 111.2 -173.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -152.71 -177.81 6.49 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 128.631 2.772 . . . . 0.0 107.355 -171.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 65.7 tttm -65.33 96.03 0.22 Allowed 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 166.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -94.94 99.32 4.1 Favored Pre-proline 0 C--N 1.324 -0.52 0 C-N-CA 127.141 2.176 . . . . 0.0 108.895 -171.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -56.68 -35.75 97.75 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 123.626 2.884 . . . . 0.0 112.211 -173.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 95.0 m -92.89 -7.96 44.7 Favored 'General case' 0 N--CA 1.442 -0.843 0 C-N-CA 126.246 1.818 . . . . 0.0 113.49 -168.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.6 tp60 -61.66 -24.78 66.96 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 117.966 0.348 . . . . 0.0 110.592 179.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 61.1 tttm -56.98 -60.01 4.21 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 125.209 1.404 . . . . 0.0 109.758 167.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 19.8 mp0 -57.81 -45.6 85.86 Favored 'General case' 0 C--O 1.225 -0.204 0 C-N-CA 123.88 0.872 . . . . 0.0 110.206 -176.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -52.54 -41.82 63.84 Favored 'General case' 0 C--N 1.338 0.096 0 C-N-CA 125.055 1.342 . . . . 0.0 112.697 173.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 92.4 m -61.69 -47.51 84.98 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 117.706 0.23 . . . . 0.0 110.609 172.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -62.21 -24.51 67.26 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-O 117.8 -1.095 . . . . 0.0 112.262 -179.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 35.8 mm -56.05 -53.4 39.12 Favored 'Isoleucine or valine' 0 C--N 1.343 0.29 0 CA-C-N 120.126 1.33 . . . . 0.0 109.624 172.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -58.73 -54.35 48.03 Favored 'General case' 0 N--CA 1.445 -0.68 0 O-C-N 124.025 0.828 . . . . 0.0 109.196 -179.484 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -66.7 -31.98 73.0 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 119.132 -1.027 . . . . 0.0 111.675 -174.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 20.4 t -56.48 -48.74 76.48 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 119.362 0.983 . . . . 0.0 108.681 169.23 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.05 -46.88 84.65 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 123.178 0.591 . . . . 0.0 110.429 179.461 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -56.98 -46.28 82.35 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.663 0.785 . . . . 0.0 111.258 174.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.59 -12.74 55.82 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.127 0.971 . . . . 0.0 113.475 175.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.3 m-80 -123.87 8.65 8.75 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.65 1.18 . . . . 0.0 112.149 -173.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 58.23 40.27 24.94 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 122.376 1.084 . . . . 0.0 110.873 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.262 7.1 m-85 71.97 14.08 5.87 Favored 'General case' 0 N--CA 1.444 -0.764 0 C-N-CA 127.876 2.47 . . . . 0.0 114.66 168.8 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 65.8 mtm -69.62 86.26 0.47 Allowed 'General case' 0 N--CA 1.443 -0.823 0 C-N-CA 125.147 1.379 . . . . 0.0 109.982 169.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -53.37 -25.87 17.14 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.414 0.686 . . . . 0.0 111.4 169.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.9 m -53.4 -38.66 63.63 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.834 2.054 . . . . 0.0 112.709 171.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.6 mmtm -73.98 -47.95 33.69 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 124.224 1.01 . . . . 0.0 108.58 173.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.2 m -73.09 2.7 6.6 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 124.753 1.221 . . . . 0.0 113.567 -173.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 27.1 mm-40 -54.49 -28.44 44.82 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 119.604 1.093 . . . . 0.0 110.08 167.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.73 -58.44 8.57 Favored 'General case' 0 C--N 1.348 0.504 0 C-N-CA 126.087 1.755 . . . . 0.0 111.955 172.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.6 p -72.59 -30.28 33.4 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 C-N-CA 123.873 0.869 . . . . 0.0 110.074 -174.002 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 75.9 mt -59.18 -48.76 85.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 N-CA-C 106.229 -1.767 . . . . 0.0 106.229 168.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.1 -25.8 59.38 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 121.014 -1.054 . . . . 0.0 113.454 174.048 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 49.6 tt0 -75.08 -39.78 60.55 Favored 'General case' 0 N--CA 1.434 -1.249 0 C-N-CA 119.353 -0.939 . . . . 0.0 110.486 174.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.4 mt -57.95 -31.92 67.31 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-O 117.863 -1.065 . . . . 0.0 109.304 169.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 19.1 mmt85 -66.19 -56.9 9.06 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 120.143 1.338 . . . . 0.0 109.145 -178.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 12.3 ptmm? -67.94 -22.19 65.06 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.651 -176.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.4 t -73.16 -51.92 16.07 Favored 'General case' 0 N--CA 1.439 -1.013 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 166.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 43.1 t -60.82 -52.27 65.79 Favored 'General case' 0 CA--C 1.514 -0.442 0 C-N-CA 124.404 1.082 . . . . 0.0 112.16 -170.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.16 1.67 4.5 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.382 -0.826 . . . . 0.0 112.554 -173.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.53 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 11.6 tt0 -85.29 -11.7 54.12 Favored 'General case' 0 N--CA 1.44 -0.944 0 C-N-CA 126.451 1.9 . . . . 0.0 111.168 -179.127 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.53 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 73.8 m-85 -135.37 160.48 67.8 Favored Pre-proline 0 N--CA 1.447 -0.623 0 C-N-CA 124.907 1.283 . . . . 0.0 111.168 -168.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -65.07 120.38 7.6 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 N-CA-C 105.416 -2.571 . . . . 0.0 105.416 165.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -43.79 -40.05 4.15 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 115.158 1.54 . . . . 0.0 115.158 -167.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.58 -9.71 14.18 Favored Glycine 0 CA--C 1.533 1.202 0 C-N-CA 124.845 1.212 . . . . 0.0 114.048 178.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.43 -26.65 68.83 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 119.06 1.43 . . . . 0.0 111.478 169.517 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 11.1 t -140.23 132.12 27.63 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-O 123.235 1.493 . . . . 0.0 112.727 -169.066 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 19.1 t -68.52 -52.06 40.25 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.655 0 CA-C-N 112.762 -2.017 . . . . 0.0 108.365 175.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 12.4 m -62.86 -41.86 94.23 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 CA-C-O 118.363 -0.827 . . . . 0.0 110.313 -176.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 29.3 t -63.66 -34.11 77.12 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.669 1.588 . . . . 0.0 110.183 176.161 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.9 m -67.65 -28.72 67.96 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 122.854 0.462 . . . . 0.0 110.708 171.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -67.89 -34.03 81.29 Favored Glycine 0 C--N 1.346 1.107 0 CA-C-O 123.15 1.417 . . . . 0.0 111.315 167.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -80.38 -44.34 19.56 Favored 'General case' 0 N--CA 1.421 -1.914 0 N-CA-C 115.877 1.806 . . . . 0.0 115.877 -165.64 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -62.09 -22.64 65.96 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 118.779 -0.629 . . . . 0.0 110.393 170.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 59.2 tttp -76.35 -46.25 28.37 Favored 'General case' 0 C--N 1.349 0.566 0 CA-C-N 119.233 0.924 . . . . 0.0 109.694 166.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -52.22 -39.71 60.62 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.171 0.988 . . . . 0.0 110.982 177.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -61.04 -37.82 83.98 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 126.098 1.759 . . . . 0.0 111.225 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -61.36 -47.63 85.0 Favored 'General case' 0 C--O 1.226 -0.175 0 CA-C-O 118.413 -0.803 . . . . 0.0 109.5 170.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -56.68 -38.2 71.91 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 119.194 0.907 . . . . 0.0 110.943 179.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . 0.515 ' ND2' HH12 ' A' ' 63' ' ' ARG . 2.2 m-80 -69.43 -31.1 69.23 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.918 0.887 . . . . 0.0 112.21 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 73.6 mt -76.09 -41.63 49.81 Favored 'General case' 0 C--O 1.225 -0.207 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 175.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -54.73 -38.88 67.66 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.425 1.49 . . . . 0.0 111.184 169.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.515 HH12 ' ND2' ' A' ' 60' ' ' ASN . 77.0 mtm-85 -66.63 -59.39 3.64 Favored 'General case' 0 C--N 1.345 0.41 0 CA-C-N 119.403 1.001 . . . . 0.0 109.753 169.085 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -73.1 65.74 0.8 Allowed 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 126.8 2.04 . . . . 0.0 110.918 -177.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.3 m -174.17 -164.15 0.18 Allowed 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 129.513 3.125 . . . . 0.0 105.132 -178.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -64.51 91.3 0.08 Allowed 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 167.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.4 m -65.21 41.0 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 128.976 2.91 . . . . 0.0 116.208 -168.281 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 10.8 mptt . . . . . 0 N--CA 1.465 0.316 0 C-N-CA 126.701 2.001 . . . . 0.0 110.313 175.113 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 91.2 mtp . . . . . 0 CA--C 1.538 0.486 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.83 159.94 50.57 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.425 2.083 . . . . 0.0 110.858 170.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -61.13 -26.52 67.74 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.012 1.725 . . . . 0.0 112.902 -171.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -147.38 177.15 9.46 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 127.753 2.421 . . . . 0.0 106.608 171.089 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.2 t0 -136.4 93.86 14.2 Favored Pre-proline 0 N--CA 1.448 -0.566 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 172.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -55.45 -33.53 86.26 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 124.204 3.269 . . . . 0.0 112.821 -175.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 63.1 m -94.61 -10.41 32.04 Favored 'General case' 0 N--CA 1.438 -1.068 0 C-N-CA 125.599 1.56 . . . . 0.0 113.19 -169.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 26.5 tp60 -62.6 -24.94 67.83 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 118.806 0.73 . . . . 0.0 111.161 -179.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -60.1 -54.38 46.58 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.434 1.094 . . . . 0.0 109.988 168.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -63.64 -38.83 92.62 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.655 0.782 . . . . 0.0 110.242 -177.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.14 -43.46 70.55 Favored 'General case' 0 C--N 1.341 0.197 0 C-N-CA 124.98 1.312 . . . . 0.0 112.645 169.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 77.8 m -57.56 -44.71 85.48 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 121.228 -0.189 . . . . 0.0 110.731 173.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -62.01 -25.81 67.87 Favored 'General case' 0 C--O 1.226 -0.137 0 CA-C-O 117.779 -1.105 . . . . 0.0 112.14 178.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 22.9 mm -59.38 -54.18 37.94 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.288 0 CA-C-N 120.251 1.387 . . . . 0.0 109.393 173.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -59.47 -53.45 58.05 Favored 'General case' 0 N--CA 1.445 -0.708 0 O-C-N 123.991 0.807 . . . . 0.0 109.014 -178.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.47 -31.99 72.52 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 118.987 -1.085 . . . . 0.0 111.664 -175.585 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.0 t -55.82 -48.03 76.16 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 119.42 1.009 . . . . 0.0 108.728 168.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.14 -47.24 83.93 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 123.279 0.632 . . . . 0.0 110.277 179.123 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -56.92 -46.25 82.12 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.45 0.7 . . . . 0.0 111.3 174.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.4 -13.97 59.86 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.017 0.927 . . . . 0.0 113.301 175.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.4 m-80 -124.13 10.32 8.73 Favored 'General case' 0 C--N 1.342 0.278 0 C-N-CA 124.458 1.103 . . . . 0.0 112.121 -173.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 14.8 m 58.22 39.99 25.24 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 119.825 1.193 . . . . 0.0 111.129 178.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.275 6.9 m-85 73.27 14.76 4.47 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 127.902 2.481 . . . . 0.0 114.774 168.635 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 50.6 mtm -66.57 85.15 0.11 Allowed 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 125.677 1.591 . . . . 0.0 110.251 169.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -56.95 -18.18 12.48 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.609 1.164 . . . . 0.0 112.157 170.124 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.4 p -61.5 -58.27 8.83 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 127.138 2.175 . . . . 0.0 110.797 167.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.5 mmtp -54.43 -41.0 68.88 Favored 'General case' 0 C--N 1.339 0.121 0 C-N-CA 123.392 0.677 . . . . 0.0 109.415 173.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.3 m -80.65 7.12 10.84 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -176.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 79.6 mm-40 -59.35 -27.42 65.92 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.833 1.197 . . . . 0.0 110.841 167.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.22 -54.3 48.41 Favored 'General case' 0 C--N 1.345 0.379 0 C-N-CA 125.513 1.525 . . . . 0.0 111.63 173.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.2 p -76.58 -28.74 17.88 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.811 0 C-N-CA 123.69 0.796 . . . . 0.0 109.838 -175.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 22.4 mt -59.74 -46.41 93.53 Favored 'Isoleucine or valine' 0 C--N 1.344 0.335 0 N-CA-C 107.034 -1.469 . . . . 0.0 107.034 167.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.34 -30.33 51.1 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 123.166 0.586 . . . . 0.0 112.358 173.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -78.18 -39.73 39.88 Favored 'General case' 0 N--CA 1.429 -1.518 0 C-N-CA 120.232 -0.587 . . . . 0.0 111.633 177.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.9 mt -63.65 -33.02 74.7 Favored 'General case' 0 C--N 1.343 0.315 0 CA-C-N 119.559 1.072 . . . . 0.0 110.362 172.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.12 -61.92 2.2 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.942 1.297 . . . . 0.0 109.406 175.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.9 ptmt -65.92 -29.76 70.23 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 114.51 -1.223 . . . . 0.0 110.888 -174.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 52.1 t -62.56 -51.21 68.27 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 168.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.6 t -60.54 -46.75 89.03 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.324 0.65 . . . . 0.0 111.309 -173.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.73 -1.94 4.42 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 125.097 1.359 . . . . 0.0 113.247 -179.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.522 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 21.0 tt0 -80.18 -10.87 59.78 Favored 'General case' 0 N--CA 1.44 -0.969 0 C-N-CA 123.969 0.907 . . . . 0.0 110.591 172.293 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.522 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 68.3 m-85 -139.37 161.06 59.25 Favored Pre-proline 0 N--CA 1.447 -0.613 0 C-N-CA 124.556 1.143 . . . . 0.0 112.476 -168.454 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -68.21 123.49 10.65 Favored 'Trans proline' 0 N--CA 1.457 -0.675 0 N-CA-C 104.814 -2.802 . . . . 0.0 104.814 164.095 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.0 ptmt -48.97 -33.63 11.37 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 116.5 2.037 . . . . 0.0 116.5 -166.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.85 -15.05 40.28 Favored Glycine 0 CA--C 1.532 1.134 0 CA-C-N 118.899 0.772 . . . . 0.0 113.806 178.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.8 tpm_? -64.58 -12.95 50.44 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 125.223 1.409 . . . . 0.0 112.457 171.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.9 t -149.93 141.09 23.07 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 122.478 1.132 . . . . 0.0 111.756 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.5 t -71.8 -54.12 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 CA-C-N 114.571 -1.195 . . . . 0.0 108.913 178.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 6.8 m -59.52 -39.46 79.38 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 122.63 0.372 . . . . 0.0 110.085 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 12.2 t -67.54 -37.23 82.4 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.686 1.195 . . . . 0.0 110.176 177.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 54.1 m -63.7 -27.83 69.48 Favored 'General case' 0 N--CA 1.453 -0.32 0 O-C-N 121.883 -0.511 . . . . 0.0 110.87 172.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.29 -25.47 72.96 Favored Glycine 0 C--N 1.343 0.958 0 CA-C-O 122.025 0.791 . . . . 0.0 112.195 170.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -82.35 -49.45 10.01 Favored 'General case' 0 N--CA 1.433 -1.309 0 C-N-CA 126.087 1.755 . . . . 0.0 115.12 -167.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -66.23 -20.97 66.27 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.105 172.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -72.05 -40.7 68.16 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 118.514 0.597 . . . . 0.0 109.967 166.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -55.53 -45.94 77.12 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 119.457 1.026 . . . . 0.0 109.825 169.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 30.1 tp10 -63.67 -34.29 77.52 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.821 0.848 . . . . 0.0 111.391 178.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -60.89 -31.91 71.37 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 118.731 0.696 . . . . 0.0 111.514 172.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -67.64 -53.26 29.36 Favored 'General case' 0 C--N 1.341 0.198 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 168.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -64.78 -34.89 79.41 Favored 'General case' 0 C--O 1.231 0.115 0 C-N-CA 123.797 0.839 . . . . 0.0 112.385 -168.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 4.2 pp -61.73 -19.32 62.28 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 118.799 0.727 . . . . 0.0 112.639 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 40.5 p -65.68 -53.63 38.51 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-N 118.798 0.726 . . . . 0.0 109.421 170.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.433 ' C ' ' H ' ' A' ' 65' ' ' SER . 0.0 OUTLIER -63.13 -36.77 84.71 Favored 'General case' 0 C--N 1.339 0.116 0 C-N-CA 124.396 1.078 . . . . 0.0 111.037 178.783 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -69.36 17.94 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 177.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.433 ' H ' ' C ' ' A' ' 63' ' ' ARG . 66.3 m -69.04 169.75 11.23 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 125.441 1.496 . . . . 0.0 109.869 168.236 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.74 139.52 53.68 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 121.161 0.505 . . . . 0.0 110.19 171.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 41.8 m -168.1 172.27 8.88 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 126.615 1.966 . . . . 0.0 107.49 175.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 63.4 tttp . . . . . 0 CA--C 1.531 0.219 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 174.091 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.6 mtt . . . . . 0 CA--C 1.539 0.536 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -78.49 64.46 8.55 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 123.738 2.959 . . . . 0.0 110.801 176.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -68.52 24.58 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 127.013 2.125 . . . . 0.0 113.731 -176.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt 47.59 -127.74 1.73 Allowed 'General case' 0 C--N 1.344 0.34 0 C-N-CA 125.088 1.355 . . . . 0.0 108.617 -169.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -91.28 97.5 1.36 Allowed Pre-proline 0 C--N 1.32 -0.693 0 N-CA-C 106.369 -1.715 . . . . 0.0 106.369 168.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -56.01 -37.04 96.75 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 123.536 2.824 . . . . 0.0 112.362 -169.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 67.5 m -92.92 -8.86 42.03 Favored 'General case' 0 N--CA 1.438 -1.053 0 C-N-CA 125.707 1.603 . . . . 0.0 113.396 -168.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 28.8 tp60 -62.27 -25.05 67.63 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 118.321 0.509 . . . . 0.0 110.51 178.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.3 tmtm? -58.27 -56.93 15.69 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.387 1.075 . . . . 0.0 109.446 168.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 21.1 mp0 -61.96 -39.13 91.07 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.037 0.935 . . . . 0.0 110.749 -177.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -55.27 -44.83 76.0 Favored 'General case' 0 C--N 1.338 0.108 0 C-N-CA 124.319 1.048 . . . . 0.0 112.203 170.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.4 m -59.02 -41.65 88.28 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 121.06 -0.256 . . . . 0.0 111.078 172.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -64.26 -21.96 66.78 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-O 117.432 -1.27 . . . . 0.0 112.941 176.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 44.3 mm -59.64 -51.1 76.74 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-N 121.029 1.74 . . . . 0.0 109.34 172.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 8.4 mm-40 -61.14 -55.89 27.19 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 108.274 -1.009 . . . . 0.0 108.274 178.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 17.7 mtpp -66.2 -27.84 68.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 118.405 -0.807 . . . . 0.0 111.481 -172.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 15.7 t -56.71 -51.36 69.1 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 119.14 0.882 . . . . 0.0 109.034 168.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.05 -46.71 78.83 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 123.524 0.729 . . . . 0.0 110.723 178.061 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.448 ' HA ' ' CE1' ' A' ' 23' ' ' TYR . 1.5 mp0 -56.86 -44.49 82.23 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 122.908 0.483 . . . . 0.0 111.635 174.883 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.18 -14.38 61.79 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 177.061 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -120.89 14.19 11.55 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.362 1.065 . . . . 0.0 113.248 -168.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 17.2 m 60.98 35.98 18.81 Favored 'General case' 0 C--N 1.346 0.442 0 CA-C-N 120.55 1.523 . . . . 0.0 110.035 -178.244 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.448 ' CE1' ' HA ' ' A' ' 19' ' ' GLN . 45.4 m-85 66.63 16.68 10.46 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 126.516 1.926 . . . . 0.0 113.597 168.555 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 58.0 mtm -72.27 88.04 1.14 Allowed 'General case' 0 N--CA 1.438 -1.039 0 C-N-CA 126.36 1.864 . . . . 0.0 108.808 173.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -52.85 -27.97 20.78 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.016 0.927 . . . . 0.0 110.532 170.577 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.0 m -57.22 -35.94 70.28 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 127.184 2.194 . . . . 0.0 113.325 171.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.5 mmtm -72.82 -43.5 62.6 Favored 'General case' 0 C--O 1.233 0.214 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 170.595 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . 0.25 74.7 m -73.42 1.42 9.77 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 123.875 0.87 . . . . 0.0 113.116 -170.495 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 61.6 mm-40 -55.56 -31.87 62.53 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.319 -0.863 . . . . 0.0 109.919 165.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.97 -53.48 57.78 Favored 'General case' 0 C--N 1.346 0.423 0 C-N-CA 124.531 1.132 . . . . 0.0 111.684 173.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.5 p -75.97 -24.47 16.6 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 C-N-CA 122.863 0.465 . . . . 0.0 110.245 -174.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 40.3 mt -62.53 -49.38 84.05 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 N-CA-C 106.561 -1.644 . . . . 0.0 106.561 167.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -55.92 -29.9 60.8 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 118.94 0.791 . . . . 0.0 111.142 174.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -71.42 -44.19 65.34 Favored 'General case' 0 N--CA 1.446 -0.628 0 O-C-N 121.313 -0.867 . . . . 0.0 112.288 175.16 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.405 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.3 mt -59.77 -33.44 71.7 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-N 119.038 0.835 . . . . 0.0 109.777 172.132 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.6 ttt-85 -62.21 -57.01 13.04 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 126.052 1.741 . . . . 0.0 110.629 178.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -62.9 -35.64 80.71 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 124.486 1.114 . . . . 0.0 110.872 -179.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.3 t -62.38 -50.27 72.24 Favored 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 169.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 52.6 t -63.94 -48.93 74.59 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 123.2 0.6 . . . . 0.0 111.724 -170.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.4 -0.65 5.14 Favored 'General case' 0 N--CA 1.444 -0.737 0 C-N-CA 124.575 1.15 . . . . 0.0 112.091 -177.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.435 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 2.1 tp-100 -80.06 -7.49 58.89 Favored 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 123.797 0.839 . . . . 0.0 110.963 173.475 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.435 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 73.3 m-85 -143.28 161.36 48.1 Favored Pre-proline 0 N--CA 1.444 -0.749 0 C-N-CA 124.286 1.035 . . . . 0.0 112.472 -168.74 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -69.24 110.15 2.38 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 N-CA-C 105.284 -2.622 . . . . 0.0 105.284 164.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -43.52 -30.49 0.58 Allowed 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 117.937 2.569 . . . . 0.0 117.937 -166.584 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -55.39 -16.44 9.98 Favored Glycine 0 CA--C 1.538 1.5 0 CA-C-N 119.559 1.072 . . . . 0.0 114.071 172.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 12.7 tpt180 -54.12 -28.22 38.22 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 127.062 2.145 . . . . 0.0 111.789 168.432 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.2 t -146.63 140.89 26.35 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-O 122.483 1.135 . . . . 0.0 112.36 -169.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 11.7 t -69.26 -55.66 14.54 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-N 114.107 -1.406 . . . . 0.0 108.941 178.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 7.6 m -59.21 -41.72 84.73 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 122.897 0.479 . . . . 0.0 109.915 -177.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 14.0 t -67.33 -35.55 79.64 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.967 1.307 . . . . 0.0 110.044 179.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 54.7 m -65.95 -23.63 66.64 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 118.734 -0.651 . . . . 0.0 111.156 172.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -77.12 -26.91 61.0 Favored Glycine 0 C--N 1.345 1.04 0 CA-C-O 122.423 1.013 . . . . 0.0 111.832 168.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.405 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.4 OUTLIER -80.15 -41.54 25.18 Favored 'General case' 0 N--CA 1.42 -1.958 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 -166.8 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -62.27 -20.49 64.33 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 123.883 0.739 . . . . 0.0 111.164 177.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -67.29 -54.96 16.08 Favored 'General case' 0 C--N 1.348 0.531 0 CA-C-N 118.823 0.738 . . . . 0.0 109.647 167.511 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.9 tp10 -56.42 -41.67 76.75 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.57 1.148 . . . . 0.0 111.15 178.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -57.75 -42.29 83.66 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 127.808 2.443 . . . . 0.0 110.727 -179.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -67.2 -33.6 75.72 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.972 1.309 . . . . 0.0 111.471 177.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 47.3 mm-40 -66.49 -48.91 68.32 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 121.814 0.816 . . . . 0.0 109.66 169.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -70.51 -33.72 71.51 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 117.089 -1.434 . . . . 0.0 113.256 -168.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 4.0 pp -59.47 -12.78 6.8 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 119.615 1.098 . . . . 0.0 113.462 -175.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 35.5 p -55.7 -60.5 3.36 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.436 1.495 . . . . 0.0 108.787 167.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 45.3 ttp180 -71.6 -63.96 1.02 Allowed 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 127.771 2.428 . . . . 0.0 110.081 172.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -80.61 45.06 0.76 Allowed 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 128.988 2.915 . . . . 0.0 111.335 -171.291 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -76.27 179.91 5.48 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 126.069 1.748 . . . . 0.0 110.155 168.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.07 -178.94 0.5 Allowed 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.185 0.994 . . . . 0.0 110.788 168.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 6.9 m -65.62 66.96 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 127.068 2.147 . . . . 0.0 113.771 -176.229 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 47.0 mtmt . . . . . 0 N--CA 1.464 0.233 0 C-N-CA 126.436 1.894 . . . . 0.0 110.245 176.888 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.871 ' H2 ' HH12 ' A' ' 46' ' ' ARG . 26.1 mmt . . . . . 0 CA--C 1.538 0.509 0 CA-C-O 118.861 -0.59 . . . . 0.0 109.592 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -75.9 70.5 5.88 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 123.365 2.71 . . . . 0.0 109.558 169.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -141.91 165.12 28.33 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 127.339 2.256 . . . . 0.0 109.418 -178.567 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -65.77 -178.93 0.62 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.558 1.143 . . . . 0.0 112.523 -178.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.2 t0 -93.01 97.65 1.9 Allowed Pre-proline 0 CA--C 1.539 0.533 0 N-CA-C 106.148 -1.797 . . . . 0.0 106.148 168.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo -62.04 -30.67 83.24 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 124.318 3.345 . . . . 0.0 112.685 -172.131 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 89.9 m -93.29 -14.17 27.3 Favored 'General case' 0 N--CA 1.437 -1.076 0 C-N-CA 124.863 1.265 . . . . 0.0 112.299 -168.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 21.4 tp60 -60.48 -25.53 66.12 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 123.432 0.693 . . . . 0.0 110.739 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 65.9 tttp -62.08 -56.85 14.71 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 124.14 0.976 . . . . 0.0 110.162 168.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -61.15 -37.7 83.79 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.788 0.835 . . . . 0.0 110.481 -176.355 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.49 -43.64 71.96 Favored 'General case' 0 CA--C 1.52 -0.195 0 C-N-CA 125.186 1.394 . . . . 0.0 112.826 169.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.8 m -58.75 -43.86 90.39 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 121.028 0.442 . . . . 0.0 110.817 173.092 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 40.2 mm-40 -64.27 -21.1 66.47 Favored 'General case' 0 N--CA 1.456 -0.151 0 CA-C-O 117.735 -1.126 . . . . 0.0 112.387 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 36.8 mm -60.12 -52.62 59.1 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 CA-C-N 120.574 1.534 . . . . 0.0 109.363 171.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -58.27 -55.52 33.96 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 107.624 -1.251 . . . . 0.0 107.624 -179.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 41.1 mtpt -70.02 -29.44 66.5 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 118.201 -0.904 . . . . 0.0 111.64 -170.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.8 t -56.87 -47.05 81.36 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 168.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.15 -45.45 90.93 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 118.377 -0.82 . . . . 0.0 110.133 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -58.47 -46.53 86.42 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 119.428 1.013 . . . . 0.0 111.222 174.228 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.05 -14.57 55.41 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.811 0.844 . . . . 0.0 113.24 176.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -122.56 9.16 9.58 Favored 'General case' 0 C--N 1.342 0.256 0 C-N-CA 124.228 1.011 . . . . 0.0 112.231 -173.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.6 m 58.25 40.23 24.91 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 122.601 1.191 . . . . 0.0 110.776 179.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.26 7.1 m-85 72.14 15.1 5.53 Favored 'General case' 0 N--CA 1.443 -0.812 0 C-N-CA 127.914 2.485 . . . . 0.0 114.316 169.075 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 67.3 mtm -70.44 86.82 0.62 Allowed 'General case' 0 N--CA 1.441 -0.915 0 C-N-CA 125.5 1.52 . . . . 0.0 110.047 169.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -55.05 -23.47 20.19 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 125.769 1.628 . . . . 0.0 110.569 168.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -55.26 -41.53 72.31 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.864 1.665 . . . . 0.0 112.004 169.576 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 50.6 mmtt -73.7 -45.68 50.83 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.991 0.916 . . . . 0.0 108.555 175.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.1 m -73.68 1.6 9.92 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -172.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.491 HE22 ' NH1' ' A' ' 63' ' ' ARG . 65.4 mm-40 -51.81 -34.57 40.72 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 119.105 0.866 . . . . 0.0 109.986 166.509 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.68 -57.4 12.9 Favored 'General case' 0 C--N 1.346 0.425 0 C-N-CA 125.757 1.623 . . . . 0.0 111.447 175.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.7 p -72.44 -29.79 32.45 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.645 0 C-N-CA 123.618 0.767 . . . . 0.0 110.194 -173.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 56.2 mt -59.97 -50.66 79.27 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 N-CA-C 106.129 -1.804 . . . . 0.0 106.129 168.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.51 HE22 ' NH1' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -56.91 -28.84 62.47 Favored 'General case' 0 N--CA 1.448 -0.574 0 O-C-N 121.635 -0.666 . . . . 0.0 112.77 175.306 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -74.99 -37.94 61.74 Favored 'General case' 0 N--CA 1.432 -1.361 0 CA-C-N 118.585 0.63 . . . . 0.0 111.39 177.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.4 mt -59.27 -34.11 71.86 Favored 'General case' 0 C--N 1.346 0.418 0 CA-C-N 119.502 1.046 . . . . 0.0 109.872 169.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.51 ' NH1' HE22 ' A' ' 33' ' ' GLN . 0.8 OUTLIER -67.13 -55.62 13.43 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.214 1.406 . . . . 0.0 111.732 179.722 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 57.4 mttm -62.09 -33.31 74.19 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 124.822 1.249 . . . . 0.0 110.326 178.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.3 t -64.2 -52.76 57.29 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 168.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.4 t -57.7 -50.31 73.63 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 123.762 0.825 . . . . 0.0 112.079 -172.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.79 -0.87 7.84 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 114.961 -1.018 . . . . 0.0 112.444 -175.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.434 ' HB3' ' CE1' ' A' ' 42' ' ' TYR . 2.7 tp-100 -85.38 -6.57 59.21 Favored 'General case' 0 N--CA 1.437 -1.111 0 C-N-CA 124.345 1.058 . . . . 0.0 111.548 179.408 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.434 ' CE1' ' HB3' ' A' ' 41' ' ' GLN . 77.9 m-85 -140.26 160.23 60.68 Favored Pre-proline 0 N--CA 1.445 -0.685 0 C-N-CA 124.472 1.109 . . . . 0.0 111.609 -168.7 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -67.37 118.17 5.38 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 N-CA-C 106.408 -2.189 . . . . 0.0 106.408 166.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 62.1 tttm -41.27 -38.15 1.1 Allowed 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 117.024 2.231 . . . . 0.0 117.024 -168.019 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.28 -13.62 16.28 Favored Glycine 0 CA--C 1.537 1.418 0 C-N-CA 123.997 0.808 . . . . 0.0 114.066 176.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.871 HH12 ' H2 ' ' A' ' 1' ' ' MET . 0.1 OUTLIER -56.77 -31.12 64.3 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 126.381 1.872 . . . . 0.0 112.057 169.495 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.5 t -146.01 136.97 24.5 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-O 123.113 1.435 . . . . 0.0 113.798 -168.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.1 t -71.89 -54.57 16.37 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.735 0 CA-C-N 112.726 -2.034 . . . . 0.0 108.833 177.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 17.7 m -60.19 -39.36 80.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 C-N-CA 123.004 0.522 . . . . 0.0 110.558 -178.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 6.3 t -66.54 -38.9 88.13 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.102 1.361 . . . . 0.0 109.954 176.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 51.2 m -64.88 -26.64 68.41 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-O 119.231 -0.414 . . . . 0.0 110.822 172.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.34 -26.47 71.92 Favored Glycine 0 C--N 1.342 0.915 0 CA-C-N 118.088 0.404 . . . . 0.0 112.291 169.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -81.2 -48.11 12.52 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 115.893 1.812 . . . . 0.0 115.893 -165.737 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -64.5 -19.14 65.4 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.243 173.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -80.27 -42.93 22.23 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.068 0.849 . . . . 0.0 109.928 166.005 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -56.22 -33.9 65.79 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.663 1.185 . . . . 0.0 110.865 176.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.7 tm-20 -58.75 -36.2 73.97 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.524 1.13 . . . . 0.0 110.47 176.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -73.45 -41.07 63.66 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.224 0.61 . . . . 0.0 109.701 174.172 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -57.54 -34.5 69.21 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.557 0.743 . . . . 0.0 112.057 174.355 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . 0.495 ' ND2' ' HE ' ' A' ' 63' ' ' ARG . 1.3 m-80 -60.82 -29.69 69.64 Favored 'General case' 0 C--N 1.332 -0.158 0 C-N-CA 123.664 0.786 . . . . 0.0 112.284 -178.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 54.5 mt -58.77 -30.57 67.65 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.767 0.827 . . . . 0.0 111.051 172.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 20.5 p -81.54 -47.76 12.67 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 124.818 1.247 . . . . 0.0 110.779 173.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.495 ' HE ' ' ND2' ' A' ' 60' ' ' ASN . 23.3 mtm105 -54.78 -57.47 11.42 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 123.601 0.76 . . . . 0.0 110.47 -178.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.454 ' HG3' ' H ' ' A' ' 65' ' ' SER . 1.0 OUTLIER 40.32 -130.98 0.34 Allowed 'General case' 0 C--O 1.237 0.401 0 C-N-CA 125.696 1.599 . . . . 0.0 110.611 176.095 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.454 ' H ' ' HG3' ' A' ' 64' ' ' LYS . 11.0 m -62.24 -20.63 64.43 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 126.495 1.918 . . . . 0.0 115.535 -176.459 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -83.48 19.83 1.49 Allowed 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 127.855 2.462 . . . . 0.0 113.298 175.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 74.6 m -66.58 76.04 0.11 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 126.244 1.818 . . . . 0.0 109.184 169.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.466 0.35 0 C-N-CA 127.188 2.195 . . . . 0.0 111.588 -170.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 CA--C 1.542 0.666 0 CA-C-O 119.816 -0.135 . . . . 0.0 111.071 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -80.52 48.6 2.94 Favored 'Trans proline' 0 CA--C 1.545 1.033 0 C-N-CA 123.389 2.726 . . . . 0.0 112.362 -172.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -57.39 91.45 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 126.648 1.979 . . . . 0.0 112.35 -169.039 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.7 mptp? 46.76 19.57 0.09 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 129.172 2.989 . . . . 0.0 113.387 -169.318 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -145.97 98.67 4.39 Favored Pre-proline 0 N--CA 1.442 -0.827 0 C-N-CA 128.318 2.647 . . . . 0.0 105.964 -168.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -53.56 -31.51 59.59 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 124.363 3.375 . . . . 0.0 112.868 -169.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 73.0 m -94.26 -13.69 26.27 Favored 'General case' 0 N--CA 1.428 -1.553 0 C-N-CA 126.384 1.874 . . . . 0.0 112.735 -170.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 32.3 tp60 -63.11 -25.58 68.43 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 118.898 0.772 . . . . 0.0 110.767 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -60.37 -53.62 55.45 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.979 0.912 . . . . 0.0 110.191 169.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -64.86 -38.97 92.74 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.249 0.62 . . . . 0.0 110.155 -178.162 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.07 -45.33 71.7 Favored 'General case' 0 C--N 1.341 0.216 0 C-N-CA 125.186 1.394 . . . . 0.0 112.061 169.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 89.1 m -57.33 -43.05 83.05 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 117.632 0.196 . . . . 0.0 110.473 173.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -65.06 -25.29 67.75 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-O 117.547 -1.216 . . . . 0.0 113.053 176.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 30.2 mm -58.71 -52.01 65.1 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 CA-C-N 120.677 1.581 . . . . 0.0 108.961 171.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -60.8 -53.5 56.65 Favored 'General case' 0 N--CA 1.442 -0.862 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 -175.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 16.2 mtpp -69.28 -31.1 69.38 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 118.215 -0.898 . . . . 0.0 111.849 -174.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.9 t -56.87 -45.9 82.18 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 169.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.6 -45.26 92.44 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-O 118.481 -0.771 . . . . 0.0 110.467 179.162 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -58.43 -44.81 89.26 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 119.219 0.918 . . . . 0.0 111.314 173.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.24 -13.46 58.38 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 113.345 0.869 . . . . 0.0 113.345 175.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 -124.82 9.35 8.22 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 124.483 1.113 . . . . 0.0 112.405 -172.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.3 m 58.04 40.12 25.69 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 122.318 1.056 . . . . 0.0 110.862 179.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.258 6.7 m-85 72.23 13.35 5.71 Favored 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 127.854 2.462 . . . . 0.0 114.661 168.737 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 67.3 mtm -70.78 85.87 0.67 Allowed 'General case' 0 N--CA 1.442 -0.851 0 C-N-CA 125.039 1.336 . . . . 0.0 109.798 170.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -53.58 -25.85 19.08 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.178 0.591 . . . . 0.0 111.45 171.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.1 m -51.09 -42.02 60.36 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 126.13 1.772 . . . . 0.0 112.317 170.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 55.1 mmtt -70.89 -47.59 58.34 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 124.188 0.995 . . . . 0.0 108.93 174.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.2 m -72.7 2.71 6.07 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 124.662 1.185 . . . . 0.0 113.171 -174.408 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 52.4 mm-40 -56.23 -28.25 57.78 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 119.814 1.188 . . . . 0.0 109.874 166.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.97 -56.24 24.33 Favored 'General case' 0 C--N 1.346 0.44 0 C-N-CA 125.313 1.445 . . . . 0.0 111.833 172.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.1 p -75.74 -26.02 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.746 0 C-N-CA 123.625 0.77 . . . . 0.0 109.826 -174.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 57.6 mt -62.75 -44.3 99.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 N-CA-C 107.309 -1.367 . . . . 0.0 107.309 168.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.521 HE22 ' NH1' ' A' ' 36' ' ' ARG . 2.9 tp-100 -56.47 -28.33 59.4 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 123.506 0.723 . . . . 0.0 112.379 172.401 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -74.98 -44.02 50.69 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 118.571 0.623 . . . . 0.0 111.854 173.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.412 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.6 mt -63.64 -30.89 71.94 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 119.294 0.952 . . . . 0.0 110.901 175.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.521 ' NH1' HE22 ' A' ' 33' ' ' GLN . 0.2 OUTLIER -57.26 -59.29 5.34 Favored 'General case' 0 CA--C 1.519 -0.233 0 C-N-CA 124.443 1.097 . . . . 0.0 109.415 173.502 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 48.8 mttp -60.04 -37.7 80.57 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 113.751 -1.568 . . . . 0.0 110.972 -177.295 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 42.5 t -62.2 -52.18 64.84 Favored 'General case' 0 N--CA 1.442 -0.861 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 171.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.5 t -61.6 -45.26 94.84 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.532 0.733 . . . . 0.0 111.888 -171.343 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.407 ' HA ' ' HE3' ' A' ' 44' ' ' LYS . . . -69.75 -2.4 11.85 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.095 -0.957 . . . . 0.0 112.883 -177.343 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.444 ' HB3' ' CE1' ' A' ' 42' ' ' TYR . 2.6 tp-100 -86.3 -5.53 59.16 Favored 'General case' 0 N--CA 1.438 -1.027 0 C-N-CA 124.651 1.18 . . . . 0.0 111.565 -178.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.444 ' CE1' ' HB3' ' A' ' 41' ' ' GLN . 82.7 m-85 -139.38 160.89 60.03 Favored Pre-proline 0 N--CA 1.445 -0.715 0 C-N-CA 125.13 1.372 . . . . 0.0 110.708 -168.736 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -67.42 111.12 2.22 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 N-CA-C 104.574 -2.895 . . . . 0.0 104.574 165.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.407 ' HE3' ' HA ' ' A' ' 40' ' ' ALA . 36.4 mmtm -39.43 -40.54 0.84 Allowed 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 116.753 2.131 . . . . 0.0 116.753 -165.448 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.5 -11.81 11.28 Favored Glycine 0 CA--C 1.536 1.398 0 C-N-CA 124.679 1.133 . . . . 0.0 114.303 176.259 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 31.9 tpt85 -52.52 -33.83 47.06 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 127.072 2.149 . . . . 0.0 111.675 169.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.0 t -140.71 140.75 34.94 Favored 'General case' 0 N--CA 1.44 -0.966 0 CA-C-O 122.424 1.107 . . . . 0.0 111.703 -167.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 8.8 t -70.34 -54.27 19.26 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 CA-C-N 113.828 -1.533 . . . . 0.0 108.781 179.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 7.0 m -61.48 -38.05 79.19 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-O 119.211 -0.423 . . . . 0.0 110.376 -178.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 11.9 t -67.32 -37.73 83.79 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.378 1.071 . . . . 0.0 109.93 176.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 45.2 m -64.97 -27.04 68.57 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.817 -0.552 . . . . 0.0 110.649 172.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -71.36 -26.84 72.61 Favored Glycine 0 C--N 1.344 0.993 0 CA-C-O 121.74 0.633 . . . . 0.0 112.136 169.485 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.412 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -82.04 -48.18 11.73 Favored 'General case' 0 N--CA 1.432 -1.34 0 C-N-CA 126.059 1.744 . . . . 0.0 115.074 -167.153 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -64.65 -16.04 62.19 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-O 118.732 -0.651 . . . . 0.0 110.794 172.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.85 -46.57 16.62 Favored 'General case' 0 C--N 1.347 0.461 0 C-N-CA 123.905 0.882 . . . . 0.0 109.064 165.29 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.2 tp10 -53.32 -34.51 57.73 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.993 0.917 . . . . 0.0 111.061 175.105 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -60.25 -36.54 77.99 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.931 1.692 . . . . 0.0 111.542 175.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -67.69 -31.03 70.72 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.71 0.804 . . . . 0.0 110.881 176.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -70.31 -48.51 56.31 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 169.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -65.49 -32.93 74.8 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 124.056 0.943 . . . . 0.0 112.401 -169.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 4.1 pp -64.55 -9.88 22.16 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 175.022 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 27.0 p -83.9 -52.25 6.51 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 123.849 0.86 . . . . 0.0 109.115 168.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 9.3 mtp180 -58.7 -66.07 0.56 Allowed 'General case' 0 C--N 1.343 0.326 0 C-N-CA 126.982 2.113 . . . . 0.0 110.408 -179.184 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 26.0 mtmt -82.46 73.47 9.5 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 105.34 -2.096 . . . . 0.0 105.34 168.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.5 m -55.4 141.38 36.52 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.225 1.01 . . . . 0.0 112.148 -168.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . 44.59 42.96 6.15 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.368 1.467 . . . . 0.0 112.113 -176.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 30.3 m -162.48 -171.45 2.78 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 126.823 2.049 . . . . 0.0 107.375 179.044 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 49.3 mtpt . . . . . 0 CA--C 1.535 0.396 0 O-C-N 121.22 -0.925 . . . . 0.0 109.564 178.855 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.2 mtm . . . . . 0 C--O 1.239 0.535 0 CA-C-O 118.391 -0.814 . . . . 0.0 109.131 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -77.44 60.68 7.15 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 C-N-CA 124.464 3.443 . . . . 0.0 111.232 -178.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -62.62 -36.99 84.54 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 126.243 1.817 . . . . 0.0 110.912 -176.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.0 mtpp -72.84 75.59 1.15 Allowed 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 168.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -97.82 103.58 17.63 Favored Pre-proline 0 CA--C 1.541 0.63 0 C-N-CA 127.306 2.243 . . . . 0.0 109.977 -169.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -55.15 -32.02 78.19 Favored 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 124.37 3.38 . . . . 0.0 113.418 -176.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 66.3 m -98.53 -10.98 22.7 Favored 'General case' 0 N--CA 1.437 -1.099 0 C-N-CA 125.929 1.692 . . . . 0.0 113.36 -168.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 20.2 tp60 -64.09 -25.91 68.31 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 118.614 0.643 . . . . 0.0 111.126 -179.104 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -59.34 -55.78 30.43 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.016 0.926 . . . . 0.0 109.54 169.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -63.92 -36.05 82.67 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.539 0.735 . . . . 0.0 110.126 -177.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -60.46 -39.16 86.57 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 124.047 0.939 . . . . 0.0 112.065 174.095 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 70.9 m -58.18 -44.76 88.19 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 118.494 0.588 . . . . 0.0 110.553 171.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 30.4 mm-40 -64.58 -22.68 67.04 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 117.745 -1.122 . . . . 0.0 112.393 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 43.8 mm -58.55 -55.14 24.65 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.263 0 CA-C-N 120.377 1.444 . . . . 0.0 109.302 171.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -60.31 -53.04 62.39 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 -177.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 16.0 mtpp -68.12 -30.74 69.97 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 118.264 -0.874 . . . . 0.0 111.495 -174.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.8 t -58.49 -47.77 83.01 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 119.412 1.005 . . . . 0.0 108.657 168.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.74 -46.96 83.75 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 123.235 0.614 . . . . 0.0 110.178 179.555 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -57.42 -44.67 84.82 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.777 0.831 . . . . 0.0 111.39 173.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.72 -13.21 61.06 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 174.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 45.2 m-80 -124.25 8.46 8.51 Favored 'General case' 0 C--N 1.343 0.284 0 C-N-CA 124.515 1.126 . . . . 0.0 112.304 -172.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.1 m 59.0 40.31 22.47 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 122.44 1.115 . . . . 0.0 110.807 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.272 7.1 m-85 72.11 14.48 5.66 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 127.697 2.399 . . . . 0.0 114.649 168.636 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 60.7 mtm -69.38 84.64 0.4 Allowed 'General case' 0 N--CA 1.441 -0.875 0 C-N-CA 125.403 1.481 . . . . 0.0 110.218 169.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 51.3 tt0 -54.0 -23.18 12.45 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.066 1.347 . . . . 0.0 111.955 169.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.7 m -58.61 -47.59 83.84 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 126.114 1.765 . . . . 0.0 111.699 169.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.4 mmtm -64.64 -47.95 76.63 Favored 'General case' 0 C--N 1.342 0.244 0 C-N-CA 124.095 0.958 . . . . 0.0 108.897 175.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 71.5 m -68.95 2.13 2.9 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 124.601 1.16 . . . . 0.0 113.186 -179.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -54.58 -27.62 40.25 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 119.826 1.194 . . . . 0.0 111.598 167.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.62 -54.66 43.94 Favored 'General case' 0 C--N 1.344 0.354 0 C-N-CA 124.747 1.219 . . . . 0.0 111.936 172.155 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 10.0 p -77.62 -30.58 16.93 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.738 0 C-N-CA 123.483 0.713 . . . . 0.0 110.192 -173.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 57.9 mt -63.54 -42.26 95.52 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 169.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.531 HE22 ' NH1' ' A' ' 36' ' ' ARG . 0.1 OUTLIER -53.99 -40.47 66.96 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-N 119.981 1.264 . . . . 0.0 111.547 169.879 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -70.08 -39.82 75.36 Favored 'General case' 0 N--CA 1.435 -1.222 0 C-N-CA 118.975 -1.09 . . . . 0.0 110.345 -178.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.45 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -71.3 -27.68 63.58 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 123.654 0.782 . . . . 0.0 110.046 179.378 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.531 ' NH1' HE22 ' A' ' 33' ' ' GLN . 0.3 OUTLIER -62.25 -59.09 5.53 Favored 'General case' 0 CA--C 1.519 -0.227 0 C-N-CA 126.616 1.967 . . . . 0.0 107.714 172.053 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 58.0 mttm -59.04 -38.99 80.62 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 114.489 -1.232 . . . . 0.0 110.462 -178.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 43.7 t -59.25 -54.23 49.25 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 123.79 0.836 . . . . 0.0 108.955 172.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 47.3 t -60.42 -42.58 96.3 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 121.593 0.711 . . . . 0.0 111.922 -173.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.44 -3.35 11.04 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.787 1.235 . . . . 0.0 113.466 -179.358 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.526 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 20.7 tt0 -84.39 -9.48 58.38 Favored 'General case' 0 N--CA 1.44 -0.959 0 C-N-CA 124.381 1.073 . . . . 0.0 111.019 178.203 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.526 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 71.6 m-85 -140.37 160.98 57.53 Favored Pre-proline 0 N--CA 1.446 -0.671 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -166.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -69.66 125.83 12.66 Favored 'Trans proline' 0 N--CA 1.457 -0.633 0 N-CA-C 105.312 -2.611 . . . . 0.0 105.312 164.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 37.8 mmtt -52.91 -31.38 39.56 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 115.362 1.616 . . . . 0.0 115.362 -165.365 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.12 -13.16 26.45 Favored Glycine 0 CA--C 1.535 1.315 0 C-N-CA 124.014 0.816 . . . . 0.0 113.975 175.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.9 tpm_? -65.48 -15.38 62.59 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.481 1.912 . . . . 0.0 112.748 169.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.1 t -153.26 137.57 16.61 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 120.095 1.316 . . . . 0.0 112.612 -173.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 20.4 t -68.26 -55.65 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.658 0 CA-C-N 113.784 -1.553 . . . . 0.0 108.813 174.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 7.5 m -61.26 -43.65 96.91 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 CA-C-O 118.881 -0.581 . . . . 0.0 110.079 -174.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 11.1 t -63.87 -33.55 75.95 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.776 1.631 . . . . 0.0 110.01 178.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 61.5 m -67.1 -26.2 66.59 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 119.127 -0.463 . . . . 0.0 111.118 172.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.77 -33.4 57.89 Favored Glycine 0 C--N 1.345 1.042 0 CA-C-O 123.313 1.507 . . . . 0.0 111.055 167.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.45 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.7 OUTLIER -78.23 -41.72 33.4 Favored 'General case' 0 N--CA 1.42 -1.932 0 N-CA-C 116.318 1.969 . . . . 0.0 116.318 -164.82 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -65.71 -16.97 64.27 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 118.483 -0.77 . . . . 0.0 111.675 170.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 10.8 mmpt? -80.4 -43.88 20.29 Favored 'General case' 0 C--N 1.345 0.385 0 CA-C-N 119.493 1.042 . . . . 0.0 109.343 166.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -57.32 -31.14 65.39 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 118.275 0.488 . . . . 0.0 111.382 173.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -61.59 -36.26 80.2 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 124.352 1.061 . . . . 0.0 109.902 178.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -63.79 -39.07 93.35 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 118.392 0.542 . . . . 0.0 110.194 175.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 27.4 tp10 -61.04 -52.76 63.59 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.759 0.424 . . . . 0.0 110.885 169.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -70.96 -26.79 63.32 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 118.886 -0.578 . . . . 0.0 112.447 -170.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 28.7 mt -58.24 -22.46 52.3 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 118.638 -0.696 . . . . 0.0 112.273 171.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 26.2 p -74.44 -51.32 15.25 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 119.252 0.933 . . . . 0.0 110.183 169.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -57.88 -49.24 77.39 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 126.212 1.805 . . . . 0.0 111.081 -178.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.481 ' HZ2' ' NE2' ' A' ' 33' ' ' GLN . 39.4 ttpt -148.71 96.37 2.57 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 127.527 2.331 . . . . 0.0 107.094 -177.48 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 7.6 m -63.79 -21.09 66.26 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 114.237 1.199 . . . . 0.0 114.237 179.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.0 32.89 0.08 Allowed 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 129.029 2.931 . . . . 0.0 111.761 167.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 22.4 m -68.1 138.76 55.99 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 125.432 1.493 . . . . 0.0 109.803 177.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.7 pttm . . . . . 0 N--CA 1.449 -0.476 0 C-N-CA 125.35 1.46 . . . . 0.0 108.894 -173.206 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.9 mmm . . . . . 0 CA--C 1.539 0.535 0 CA-C-O 118.035 -0.984 . . . . 0.0 109.227 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -50.98 131.83 36.0 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 124.228 3.285 . . . . 0.0 112.883 179.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -141.98 -171.27 3.32 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 127.443 2.297 . . . . 0.0 107.688 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.11 124.39 11.4 Favored 'General case' 0 C--N 1.344 0.348 0 N-CA-C 106.027 -1.842 . . . . 0.0 106.027 168.537 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 40.3 t0 -89.16 106.05 12.21 Favored Pre-proline 0 CA--C 1.543 0.705 0 C-N-CA 123.539 0.736 . . . . 0.0 109.938 -165.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.408 ' HD3' ' HE ' ' A' ' 46' ' ' ARG . 23.6 Cg_exo -66.22 -32.04 43.2 Favored 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 125.073 3.849 . . . . 0.0 112.593 -174.499 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 99.1 m -93.85 -16.05 24.46 Favored 'General case' 0 N--CA 1.437 -1.075 0 C-N-CA 124.78 1.232 . . . . 0.0 112.562 -167.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 20.7 tp60 -59.67 -25.56 64.83 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 123.731 0.812 . . . . 0.0 111.114 177.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 51.5 tttm -61.03 -57.27 13.28 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.629 1.172 . . . . 0.0 110.097 168.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -61.64 -40.24 94.21 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.687 0.795 . . . . 0.0 110.392 -176.437 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.01 -45.89 52.33 Favored 'General case' 0 C--N 1.341 0.204 0 C-N-CA 125.334 1.454 . . . . 0.0 112.226 169.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 86.4 m -59.54 -45.46 91.72 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.738 -0.21 . . . . 0.0 110.642 175.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -60.4 -30.68 69.75 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 118.534 -0.746 . . . . 0.0 111.529 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.1 mt -64.8 -49.56 79.5 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.568 0 CA-C-N 119.451 1.023 . . . . 0.0 110.316 177.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.8 mm-40 -54.66 -56.06 23.12 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 124.118 0.886 . . . . 0.0 109.127 176.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 7.9 mptt -66.02 -33.29 75.48 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 119.592 -0.843 . . . . 0.0 111.878 -176.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 13.1 t -54.11 -49.16 69.77 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-N 119.22 0.918 . . . . 0.0 108.536 168.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.55 -47.49 84.06 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 123.878 0.871 . . . . 0.0 110.126 179.022 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -56.23 -46.94 79.33 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.603 0.761 . . . . 0.0 111.223 174.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.35 -13.2 60.24 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.1 0.96 . . . . 0.0 113.556 176.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -121.68 8.02 10.02 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.674 1.19 . . . . 0.0 111.989 -173.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 59.12 40.18 22.18 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 122.392 1.091 . . . . 0.0 110.694 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.265 7.5 m-85 72.05 14.72 5.69 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 127.911 2.485 . . . . 0.0 114.635 168.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 63.5 mtm -68.82 85.44 0.32 Allowed 'General case' 0 N--CA 1.44 -0.964 0 C-N-CA 125.086 1.354 . . . . 0.0 110.117 169.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -55.54 -19.31 9.53 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.568 1.147 . . . . 0.0 111.456 169.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.6 m -59.28 -40.71 86.99 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 127.314 2.246 . . . . 0.0 112.1 169.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.2 mmtm -73.33 -47.13 45.05 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 124.409 1.084 . . . . 0.0 108.764 175.155 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 76.3 m -73.53 6.82 2.75 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 125.211 1.404 . . . . 0.0 112.458 -177.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.603 HE22 ' NH2' ' A' ' 63' ' ' ARG . 61.5 mm-40 -53.85 -37.42 63.64 Favored 'General case' 0 C--N 1.341 0.206 0 O-C-N 120.858 -1.151 . . . . 0.0 110.601 167.464 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.32 -51.33 69.97 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.919 0.888 . . . . 0.0 111.706 179.132 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 5.8 p -75.69 -26.34 17.99 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.775 0 C-N-CA 123.084 0.554 . . . . 0.0 110.199 -176.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 58.2 mt -62.22 -49.79 82.61 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 167.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.617 HE21 ' NH2' ' A' ' 36' ' ' ARG . 2.0 tt0 -54.87 -33.26 61.71 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 118.962 0.801 . . . . 0.0 111.66 175.37 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -68.6 -41.81 79.07 Favored 'General case' 0 N--CA 1.441 -0.918 0 CA-C-O 119.024 -0.512 . . . . 0.0 111.87 174.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.6 mt -63.57 -37.1 86.04 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 117.203 -1.38 . . . . 0.0 110.984 173.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.617 ' NH2' HE21 ' A' ' 33' ' ' GLN . 2.1 ptt180 -69.1 -40.93 78.09 Favored 'General case' 0 C--N 1.344 0.328 0 CA-C-N 120.625 1.557 . . . . 0.0 109.952 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -63.07 -41.48 99.45 Favored 'General case' 0 C--N 1.341 0.235 0 CA-C-O 119.457 -0.306 . . . . 0.0 111.17 175.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.1 t -57.42 -51.69 68.39 Favored 'General case' 0 C--O 1.22 -0.483 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 172.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.3 t -58.87 -48.3 81.87 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 124.417 1.087 . . . . 0.0 111.879 -172.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.78 -1.23 6.61 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.243 -0.89 . . . . 0.0 112.781 -177.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.511 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 20.1 tt0 -80.98 -10.96 59.65 Favored 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 124.208 1.003 . . . . 0.0 110.893 175.372 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.511 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 83.6 m-85 -135.07 157.88 76.0 Favored Pre-proline 0 N--CA 1.445 -0.715 0 C-N-CA 125.304 1.442 . . . . 0.0 110.807 -168.578 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -67.57 105.75 1.14 Allowed 'Trans proline' 0 N--CA 1.455 -0.783 0 N-CA-C 104.671 -2.857 . . . . 0.0 104.671 166.324 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 22.5 pttp -39.14 -38.74 0.51 Allowed 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 117.895 2.554 . . . . 0.0 117.895 -164.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.02 -15.09 19.69 Favored Glycine 0 CA--C 1.536 1.379 0 CA-C-N 119.365 0.984 . . . . 0.0 114.04 175.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.408 ' HE ' ' HD3' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -57.5 -27.44 62.54 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 126.281 1.833 . . . . 0.0 112.853 170.06 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.8 t -134.95 137.44 43.1 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-O 122.663 1.22 . . . . 0.0 110.865 -173.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 21.6 t -70.66 -55.9 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 CA-C-N 113.904 -1.498 . . . . 0.0 108.797 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 9.7 m -58.44 -43.02 85.77 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 CA-C-O 119.203 -0.427 . . . . 0.0 110.004 -178.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 11.4 t -64.67 -35.67 81.78 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.764 1.625 . . . . 0.0 110.1 179.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 52.5 m -66.02 -25.5 67.09 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 118.959 -0.543 . . . . 0.0 110.921 172.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.42 -40.32 54.92 Favored Glycine 0 C--N 1.344 0.987 0 CA-C-O 123.935 1.853 . . . . 0.0 110.719 167.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -69.45 -40.5 77.14 Favored 'General case' 0 N--CA 1.421 -1.924 0 C-N-CA 126.136 1.774 . . . . 0.0 115.564 -166.319 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -66.4 -16.96 64.5 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 118.704 -0.665 . . . . 0.0 111.507 174.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 47.6 mttp -80.54 -44.93 18.24 Favored 'General case' 0 C--N 1.347 0.463 0 CA-C-N 119.329 0.968 . . . . 0.0 109.306 166.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -58.97 -28.54 66.41 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 117.986 0.357 . . . . 0.0 111.82 173.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -61.45 -34.94 76.27 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.636 1.174 . . . . 0.0 109.844 177.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.3 tm-20 -61.18 -45.73 93.4 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 118.581 0.628 . . . . 0.0 109.393 173.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -56.03 -53.04 61.75 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 117.838 0.29 . . . . 0.0 110.655 171.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -68.73 -29.13 67.48 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 122.958 0.503 . . . . 0.0 111.997 -170.282 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 34.8 mt -62.02 -24.13 66.86 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.889 0.876 . . . . 0.0 112.46 169.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 29.6 p -83.99 -43.95 14.66 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 119.659 1.118 . . . . 0.0 110.687 169.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.603 ' NH2' HE22 ' A' ' 29' ' ' GLN . 23.6 ttp180 -66.33 -25.73 66.96 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.76 1.624 . . . . 0.0 112.909 -177.192 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 62.7 mtpt 51.46 35.96 15.56 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 129.025 2.93 . . . . 0.0 113.699 172.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 5.7 p -69.02 146.88 52.31 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 123.126 0.57 . . . . 0.0 111.127 173.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -135.48 140.16 44.61 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 126.281 1.832 . . . . 0.0 107.823 176.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 29.1 m -174.76 -166.48 0.25 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 126.755 2.022 . . . . 0.0 108.674 -173.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 58.6 pttt . . . . . 0 CA--C 1.533 0.322 0 C-N-CA 124.549 1.14 . . . . 0.0 110.896 172.889 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 88.4 mmm . . . . . 0 CA--C 1.539 0.522 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -49.52 128.7 21.38 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 123.33 2.687 . . . . 0.0 111.373 174.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 19.4 mm100 -70.7 70.12 0.45 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.895 1.678 . . . . 0.0 110.996 -179.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.6 ptpt -71.95 -170.18 0.55 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 126.768 2.027 . . . . 0.0 109.488 168.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -139.78 88.31 12.27 Favored Pre-proline 0 CA--C 1.536 0.406 0 O-C-N 121.213 -0.929 . . . . 0.0 108.827 168.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -57.19 -31.06 89.46 Favored 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 124.039 3.159 . . . . 0.0 112.901 -175.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 54.7 m -94.27 -10.47 32.76 Favored 'General case' 0 N--CA 1.437 -1.108 0 C-N-CA 125.362 1.465 . . . . 0.0 113.052 -169.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 27.7 tp60 -63.21 -24.54 67.92 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 118.447 0.567 . . . . 0.0 111.256 -179.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.6 tppt? -60.48 -53.76 53.65 Favored 'General case' 0 C--N 1.339 0.132 0 C-N-CA 122.991 0.517 . . . . 0.0 109.97 169.276 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -62.49 -39.66 94.2 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.551 0.741 . . . . 0.0 110.004 -177.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -53.97 -45.9 71.52 Favored 'General case' 0 C--N 1.343 0.308 0 C-N-CA 125.044 1.338 . . . . 0.0 112.34 169.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 67.6 m -57.92 -42.76 85.47 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 121.333 -0.147 . . . . 0.0 110.786 174.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -65.04 -22.7 67.02 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-O 117.604 -1.189 . . . . 0.0 112.706 178.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 27.8 mm -59.41 -52.83 56.25 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.244 0 CA-C-N 120.515 1.507 . . . . 0.0 108.962 172.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 33.7 mm-40 -58.34 -53.97 52.24 Favored 'General case' 0 N--CA 1.442 -0.828 0 O-C-N 123.989 0.806 . . . . 0.0 109.051 178.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 57.1 mmtt -68.17 -30.93 70.15 Favored 'General case' 0 N--CA 1.457 -0.078 0 C-N-CA 118.507 -1.277 . . . . 0.0 111.555 -173.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 19.4 t -56.85 -48.73 77.41 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 168.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.93 -46.73 84.59 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 123.203 0.601 . . . . 0.0 110.53 179.353 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -57.16 -45.78 83.32 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.751 0.821 . . . . 0.0 111.231 174.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.98 -12.47 55.22 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 175.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -124.38 8.56 8.43 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.695 1.198 . . . . 0.0 112.387 -172.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 58.49 40.1 24.3 Favored 'General case' 0 C--N 1.345 0.393 0 CA-C-O 122.418 1.104 . . . . 0.0 110.913 179.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.259 7.0 m-85 71.88 13.7 6.02 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 127.826 2.45 . . . . 0.0 114.692 168.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 66.0 mtm -69.98 85.59 0.52 Allowed 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 125.051 1.34 . . . . 0.0 109.791 170.115 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -54.04 -24.93 18.89 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.283 0.633 . . . . 0.0 111.504 171.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.2 m -52.63 -40.33 62.66 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 126.293 1.837 . . . . 0.0 112.297 170.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.1 mmtm -71.79 -46.42 58.37 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.212 1.005 . . . . 0.0 108.794 174.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.7 m -74.67 5.29 5.03 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 124.749 1.219 . . . . 0.0 113.222 -173.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 -57.66 -26.8 62.18 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 119.196 0.907 . . . . 0.0 110.674 166.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.55 -55.7 31.18 Favored 'General case' 0 C--N 1.346 0.446 0 C-N-CA 126.21 1.804 . . . . 0.0 111.709 171.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.6 p -76.07 -27.02 17.75 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.69 0 C-N-CA 123.693 0.797 . . . . 0.0 109.759 -175.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 26.4 mt -62.41 -45.9 97.68 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 168.086 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -52.13 -36.9 52.65 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 118.755 0.707 . . . . 0.0 111.265 171.698 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -71.55 -43.38 66.49 Favored 'General case' 0 N--CA 1.433 -1.311 0 CA-C-O 118.633 -0.699 . . . . 0.0 111.678 178.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.3 mt -63.37 -31.73 72.96 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 119.637 1.108 . . . . 0.0 110.668 173.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.67 -58.47 8.32 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.495 1.118 . . . . 0.0 108.783 177.363 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 55.9 mtpt -62.32 -35.64 79.7 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 113.862 -1.517 . . . . 0.0 111.143 -178.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 41.8 t -60.9 -51.83 67.6 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 170.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 51.5 t -62.79 -49.16 76.08 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 123.406 0.682 . . . . 0.0 111.647 -170.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.05 -1.39 5.79 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.111 -0.95 . . . . 0.0 112.551 -177.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.402 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 2.2 tp-100 -84.5 -7.18 59.36 Favored 'General case' 0 N--CA 1.435 -1.194 0 C-N-CA 124.735 1.214 . . . . 0.0 111.476 177.298 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.402 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 72.9 m-85 -139.67 160.72 60.09 Favored Pre-proline 0 N--CA 1.446 -0.644 0 C-N-CA 124.705 1.202 . . . . 0.0 111.23 -169.43 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -67.29 120.14 7.19 Favored 'Trans proline' 0 N--CA 1.455 -0.788 0 N-CA-C 105.36 -2.592 . . . . 0.0 105.36 165.295 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -47.73 -32.11 5.49 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 116.086 1.884 . . . . 0.0 116.086 -167.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.33 -15.12 36.88 Favored Glycine 0 CA--C 1.536 1.364 0 CA-C-N 118.782 0.719 . . . . 0.0 113.769 176.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.89 -11.41 46.76 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 126.055 1.742 . . . . 0.0 112.419 170.058 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.0 t -153.74 136.75 15.49 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-O 123.104 1.43 . . . . 0.0 113.058 -178.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.0 t -70.52 -53.51 22.28 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 CA-C-N 113.463 -1.699 . . . . 0.0 108.798 176.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.9 m -59.73 -41.69 86.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-O 119.264 -0.398 . . . . 0.0 110.029 -178.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 10.7 t -64.42 -37.45 87.57 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.51 1.524 . . . . 0.0 110.16 177.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 48.8 m -66.17 -23.58 66.49 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 118.949 -0.548 . . . . 0.0 111.264 173.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -77.01 -25.85 63.44 Favored Glycine 0 C--N 1.346 1.089 0 CA-C-O 123.194 1.441 . . . . 0.0 111.781 168.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -81.67 -41.67 21.05 Favored 'General case' 0 N--CA 1.428 -1.538 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 -166.114 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -68.17 -23.52 64.87 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 119.174 -0.441 . . . . 0.0 110.647 171.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 17.3 tppt? -69.73 -44.68 69.78 Favored 'General case' 0 C--N 1.345 0.398 0 CA-C-N 118.888 0.767 . . . . 0.0 109.25 167.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -59.57 -31.8 69.78 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 118.807 0.731 . . . . 0.0 111.754 170.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -66.08 -55.63 15.56 Favored 'General case' 0 N--CA 1.456 -0.155 0 O-C-N 120.754 -1.216 . . . . 0.0 108.42 175.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -55.23 -36.56 66.14 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.518 0.727 . . . . 0.0 111.522 177.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -56.83 -58.32 8.63 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 124.703 1.201 . . . . 0.0 109.962 174.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 49.6 m-80 -75.08 -28.1 60.18 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -170.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 60.8 mt -56.47 -22.46 32.57 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 118.215 -0.898 . . . . 0.0 112.818 170.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 52.4 p -64.6 -47.28 79.24 Favored 'General case' 0 C--N 1.344 0.329 0 CA-C-N 119.919 1.236 . . . . 0.0 110.885 171.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.37 -57.67 8.67 Favored 'General case' 0 C--N 1.338 0.091 0 C-N-CA 124.247 1.019 . . . . 0.0 110.901 177.134 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.7 tppp? -158.33 157.59 32.69 Favored 'General case' 0 C--O 1.224 -0.249 0 C-N-CA 122.916 0.486 . . . . 0.0 110.042 -175.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 5.6 m -64.07 -18.74 64.67 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 115.056 1.502 . . . . 0.0 115.056 176.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -63.97 115.79 5.23 Favored 'General case' 0 C--N 1.317 -0.804 0 C-N-CA 128.276 2.631 . . . . 0.0 109.547 170.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 5.6 p -68.5 42.11 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 127.799 2.44 . . . . 0.0 113.928 -177.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 20.5 pttp . . . . . 0 CA--C 1.539 0.52 0 O-C-N 120.264 -1.522 . . . . 0.0 111.695 174.789 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.7 mtm . . . . . 0 CA--C 1.54 0.56 0 CA-C-O 118.817 -0.611 . . . . 0.0 110.054 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -73.18 69.3 3.99 Favored 'Trans proline' 0 CA--C 1.539 0.725 0 C-N-CA 124.534 3.49 . . . . 0.0 110.482 173.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 -64.28 -29.17 70.27 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.705 1.602 . . . . 0.0 111.769 -174.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 18.4 ptmt -72.78 65.72 0.72 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.12 1.368 . . . . 0.0 109.341 168.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -94.57 105.34 17.78 Favored Pre-proline 0 CA--C 1.541 0.599 0 C-N-CA 128.02 2.528 . . . . 0.0 110.993 -167.6 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -55.08 -31.93 77.26 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 124.177 3.251 . . . . 0.0 113.228 -178.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 84.4 m -96.77 -11.01 25.54 Favored 'General case' 0 N--CA 1.438 -1.073 0 C-N-CA 126.013 1.725 . . . . 0.0 113.6 -169.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.1 tp60 -64.12 -26.03 68.36 Favored 'General case' 0 N--CA 1.444 -0.775 0 CA-C-N 118.294 0.497 . . . . 0.0 110.721 -179.158 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.6 tptt -59.91 -56.11 25.84 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.537 0.735 . . . . 0.0 109.811 169.395 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -60.72 -39.7 89.58 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.117 0.567 . . . . 0.0 109.932 -177.192 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.43 -41.81 85.89 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.991 1.316 . . . . 0.0 112.451 171.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 98.3 m -59.71 -44.13 93.82 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.673 0.67 . . . . 0.0 110.627 171.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -64.97 -20.11 66.32 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 117.69 -1.148 . . . . 0.0 112.44 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 29.6 mm -59.04 -54.09 38.93 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 CA-C-N 120.538 1.517 . . . . 0.0 109.186 170.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 6.7 mm-40 -60.49 -53.38 58.27 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 -178.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 24.6 mttm -68.0 -30.29 69.51 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 118.222 -0.894 . . . . 0.0 111.583 -173.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 15.7 t -58.28 -47.73 82.69 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 119.386 0.994 . . . . 0.0 108.52 168.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.69 -46.83 83.8 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 118.843 -0.599 . . . . 0.0 110.282 178.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -57.55 -44.63 85.34 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.558 0.743 . . . . 0.0 111.419 173.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.85 -13.23 61.38 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 175.143 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 -123.67 8.22 8.86 Favored 'General case' 0 C--N 1.343 0.301 0 C-N-CA 124.725 1.21 . . . . 0.0 112.277 -172.365 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.3 m 58.84 40.14 23.16 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 122.37 1.081 . . . . 0.0 110.774 179.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.26 7.1 m-85 72.02 13.93 5.83 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 127.816 2.446 . . . . 0.0 114.563 168.681 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 68.1 mtm -70.77 83.27 0.64 Allowed 'General case' 0 N--CA 1.441 -0.881 0 C-N-CA 125.293 1.437 . . . . 0.0 109.777 170.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -54.41 -23.57 16.37 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.914 0.886 . . . . 0.0 111.79 172.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 4.3 m -51.98 -42.82 63.24 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 126.096 1.758 . . . . 0.0 111.907 169.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 48.4 mmtt -69.54 -48.02 61.79 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 124.559 1.144 . . . . 0.0 108.891 175.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.0 m -72.27 1.27 7.99 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 124.584 1.154 . . . . 0.0 113.307 -173.615 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 86.7 mm-40 -55.94 -26.77 49.35 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.477 1.035 . . . . 0.0 111.139 166.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.47 -57.9 10.91 Favored 'General case' 0 C--N 1.347 0.466 0 C-N-CA 125.5 1.52 . . . . 0.0 111.677 171.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 14.0 p -74.82 -29.47 22.8 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.76 0 C-N-CA 123.68 0.792 . . . . 0.0 110.145 -173.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 63.8 mt -58.77 -50.83 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.649 0 N-CA-C 105.402 -2.073 . . . . 0.0 105.402 167.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.28 -35.48 67.53 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 119.232 0.923 . . . . 0.0 112.869 175.077 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -68.31 -35.31 77.63 Favored 'General case' 0 N--CA 1.438 -1.05 0 C-N-CA 118.995 -1.082 . . . . 0.0 110.027 179.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.475 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -65.79 -26.33 67.65 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 125.155 1.382 . . . . 0.0 109.885 173.311 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 20.0 mmt85 -71.28 -50.92 27.72 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 177.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 67.2 mmtt -65.87 -25.08 67.02 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.247 179.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 47.6 t -70.36 -55.17 9.77 Favored 'General case' 0 N--CA 1.441 -0.922 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 167.257 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.3 t -60.27 -46.93 88.1 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 121.234 -0.916 . . . . 0.0 112.656 -170.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.12 2.05 6.48 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -175.188 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.54 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 11.6 tt0 -90.36 -8.99 49.34 Favored 'General case' 0 N--CA 1.442 -0.837 0 C-N-CA 126.123 1.769 . . . . 0.0 111.234 -175.681 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.54 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 74.9 m-85 -139.45 160.61 61.01 Favored Pre-proline 0 N--CA 1.445 -0.706 0 C-N-CA 124.637 1.175 . . . . 0.0 111.978 -167.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -66.12 127.97 18.64 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 N-CA-C 105.574 -2.51 . . . . 0.0 105.574 165.065 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -53.24 -32.26 47.46 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 114.271 1.211 . . . . 0.0 114.271 -166.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.82 -9.13 18.37 Favored Glycine 0 CA--C 1.535 1.343 0 C-N-CA 124.566 1.079 . . . . 0.0 114.236 175.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.3 tpm_? -68.44 -17.37 64.19 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 126.172 1.789 . . . . 0.0 112.406 169.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.9 t -149.97 137.95 20.25 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 122.641 1.21 . . . . 0.0 113.306 -170.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 26.2 t -70.11 -56.35 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 113.536 -1.665 . . . . 0.0 108.726 172.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 12.5 m -62.87 -41.72 93.71 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 CA-C-O 118.637 -0.696 . . . . 0.0 110.397 -172.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 28.0 t -63.06 -33.81 76.23 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.244 1.418 . . . . 0.0 110.118 176.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 56.9 m -67.92 -21.09 65.13 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 118.549 -0.739 . . . . 0.0 111.363 172.413 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -75.38 -39.95 34.56 Favored Glycine 0 C--N 1.344 1.004 0 CA-C-O 124.202 2.001 . . . . 0.0 110.796 166.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.475 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 1.2 t80 -73.92 -40.55 63.05 Favored 'General case' 0 N--CA 1.417 -2.097 0 CA-C-N 112.016 -2.092 . . . . 0.0 116.546 -163.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -64.01 -25.53 68.17 Favored 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 119.86 -0.736 . . . . 0.0 110.937 170.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 39.4 mmtm -72.12 -37.55 69.46 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-N 119.231 0.923 . . . . 0.0 110.036 168.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -58.06 -42.65 85.92 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.041 0.537 . . . . 0.0 110.498 171.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -64.88 -41.74 95.4 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 124.277 1.031 . . . . 0.0 110.734 179.107 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -61.01 -43.34 99.03 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 118.199 0.454 . . . . 0.0 110.853 170.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -58.99 -38.22 78.65 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 123.584 0.753 . . . . 0.0 111.385 174.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -62.08 -30.9 71.31 Favored 'General case' 0 CA--C 1.521 -0.149 0 C-N-CA 123.855 0.862 . . . . 0.0 112.368 -176.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 64.3 mt -54.23 -27.2 33.07 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.355 0.662 . . . . 0.0 112.13 170.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 29.8 p -94.38 -45.28 7.53 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.619 1.568 . . . . 0.0 110.905 173.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.479 ' C ' ' H ' ' A' ' 65' ' ' SER . 35.5 ttp85 -61.5 -26.7 68.08 Favored 'General case' 0 N--CA 1.461 0.096 0 C-N-CA 125.8 1.64 . . . . 0.0 112.517 -174.03 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.5 pptp? -61.55 4.47 0.1 Allowed 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 116.242 1.941 . . . . 0.0 116.242 176.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.479 ' H ' ' C ' ' A' ' 63' ' ' ARG . 13.1 p -74.19 -165.89 0.36 Allowed 'General case' 0 N--CA 1.443 -0.804 0 C-N-CA 128.88 2.872 . . . . 0.0 108.846 167.244 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -61.21 92.83 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.275 1.03 . . . . 0.0 110.948 175.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 53.5 p -151.74 -163.48 1.76 Allowed 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.559 1.944 . . . . 0.0 108.905 -179.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 29.3 mtmm . . . . . 0 N--CA 1.466 0.339 0 C-N-CA 125.605 1.562 . . . . 0.0 111.809 172.515 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.495 ' H3 ' ' HA ' ' A' ' 9' ' ' LYS . 4.2 mpp? . . . . . 0 CA--C 1.54 0.595 0 CA-C-O 119.102 -0.475 . . . . 0.0 109.835 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo -78.4 60.68 7.61 Favored 'Trans proline' 0 CA--C 1.544 0.998 0 C-N-CA 123.633 2.889 . . . . 0.0 111.863 -174.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -69.43 83.19 0.39 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 127.356 2.263 . . . . 0.0 110.732 -169.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.6 mttt 50.24 16.95 0.29 Allowed 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 128.289 2.635 . . . . 0.0 113.864 -169.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -144.86 98.01 4.86 Favored Pre-proline 0 N--CA 1.439 -0.979 0 C-N-CA 129.98 3.312 . . . . 0.0 104.437 -169.025 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -56.21 -30.04 78.2 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 123.91 3.073 . . . . 0.0 112.702 -169.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 69.7 m -94.25 -10.89 31.47 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.56 1.544 . . . . 0.0 112.772 -171.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 22.2 tp60 -63.94 -25.09 67.98 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 118.618 0.645 . . . . 0.0 111.045 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.495 ' HA ' ' H3 ' ' A' ' 1' ' ' MET . 46.3 tttm -59.76 -55.9 28.5 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.624 1.17 . . . . 0.0 110.024 168.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 -65.25 -33.76 76.76 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.016 0.527 . . . . 0.0 110.072 -178.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -62.52 -40.27 96.24 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.535 0.734 . . . . 0.0 112.102 172.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 74.2 m -59.03 -44.97 91.81 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.411 0.55 . . . . 0.0 110.017 171.045 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -60.05 -28.1 67.49 Favored 'General case' 0 C--O 1.226 -0.133 0 CA-C-O 117.739 -1.124 . . . . 0.0 112.037 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 43.8 mm -57.76 -55.29 22.42 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.248 0 CA-C-N 120.013 1.279 . . . . 0.0 109.703 173.052 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -57.83 -55.15 38.61 Favored 'General case' 0 N--CA 1.444 -0.725 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 -178.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.6 mptp? -66.98 -31.99 72.92 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 118.824 -1.151 . . . . 0.0 111.789 -174.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 21.2 t -56.14 -48.46 76.21 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 119.532 1.06 . . . . 0.0 108.746 169.191 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.62 -47.02 85.76 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 123.208 0.603 . . . . 0.0 110.5 179.565 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -57.04 -45.79 82.9 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.608 0.763 . . . . 0.0 111.197 174.367 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.71 -13.12 58.65 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.128 0.971 . . . . 0.0 113.406 175.627 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 -123.66 8.89 8.89 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 124.579 1.152 . . . . 0.0 112.197 -173.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 57.91 40.31 25.91 Favored 'General case' 0 C--N 1.345 0.41 0 CA-C-O 122.437 1.113 . . . . 0.0 110.989 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.262 6.8 m-85 72.34 13.93 5.5 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 127.803 2.441 . . . . 0.0 114.445 168.848 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 68.5 mtm -70.67 84.51 0.63 Allowed 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 125.118 1.367 . . . . 0.0 109.866 170.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -53.89 -24.01 14.62 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.892 0.877 . . . . 0.0 111.679 171.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.7 m -53.37 -40.37 64.94 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.028 1.731 . . . . 0.0 112.304 170.462 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 51.8 mmtt -71.92 -47.48 52.27 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.375 1.07 . . . . 0.0 108.778 174.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 71.6 m -72.53 1.89 7.33 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.771 1.229 . . . . 0.0 113.356 -174.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 74.7 mm-40 -54.76 -27.54 41.92 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 119.587 1.085 . . . . 0.0 110.911 167.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.47 -57.63 12.14 Favored 'General case' 0 C--N 1.347 0.467 0 C-N-CA 126.011 1.724 . . . . 0.0 111.961 172.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.0 p -74.41 -29.73 24.71 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.722 0 C-N-CA 123.712 0.805 . . . . 0.0 109.7 -174.333 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 72.5 mt -61.74 -45.33 98.92 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 169.207 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.64 -38.73 69.93 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 118.702 0.683 . . . . 0.0 111.914 172.551 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -70.93 -40.22 72.21 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 118.482 -1.287 . . . . 0.0 109.966 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.408 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -66.13 -26.78 67.6 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.877 0.871 . . . . 0.0 109.786 178.026 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.71 -56.03 12.42 Favored 'General case' 0 CA--C 1.513 -0.443 0 C-N-CA 125.193 1.397 . . . . 0.0 108.578 176.38 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 7.9 mptt -61.01 -32.53 72.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 113.519 -1.673 . . . . 0.0 110.436 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 47.4 t -63.94 -55.97 18.61 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 168.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 52.8 t -58.89 -46.54 87.62 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 124.007 0.923 . . . . 0.0 112.457 -170.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.87 -3.01 13.9 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.249 -0.887 . . . . 0.0 112.833 -177.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.423 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 3.1 tp-100 -86.46 -5.74 59.08 Favored 'General case' 0 N--CA 1.438 -1.052 0 C-N-CA 124.57 1.148 . . . . 0.0 111.71 -177.346 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.423 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 79.5 m-85 -138.2 159.78 66.77 Favored Pre-proline 0 N--CA 1.444 -0.747 0 C-N-CA 124.531 1.132 . . . . 0.0 111.261 -168.652 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -66.97 113.11 2.68 Favored 'Trans proline' 0 N--CA 1.454 -0.845 0 N-CA-C 105.159 -2.67 . . . . 0.0 105.159 165.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 39.6 mmtm -42.75 -35.62 1.2 Allowed 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 116.306 1.965 . . . . 0.0 116.306 -166.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.68 -15.86 20.56 Favored Glycine 0 CA--C 1.539 1.548 0 C-N-CA 124.629 1.109 . . . . 0.0 114.266 175.188 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.2 tpm_? -58.51 -24.22 59.99 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.745 2.018 . . . . 0.0 111.835 169.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 8.1 t -145.2 130.72 18.81 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-O 123.359 1.552 . . . . 0.0 112.787 -169.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.4 t -68.74 -50.71 52.62 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 CA-C-N 112.681 -2.054 . . . . 0.0 108.566 176.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.9 m -61.0 -45.37 98.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 CA-C-O 118.555 -0.735 . . . . 0.0 109.592 -178.191 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 24.4 t -61.65 -35.14 77.1 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.299 1.84 . . . . 0.0 110.304 178.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.6 m -66.96 -26.34 66.78 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.188 0.595 . . . . 0.0 111.303 172.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.84 -30.87 60.9 Favored Glycine 0 C--N 1.344 1.01 0 CA-C-O 123.437 1.576 . . . . 0.0 111.731 168.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.408 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.6 OUTLIER -81.36 -41.16 22.41 Favored 'General case' 0 N--CA 1.424 -1.733 0 N-CA-C 117.39 2.367 . . . . 0.0 117.39 -164.393 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -65.5 -27.84 68.76 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 118.9 -0.571 . . . . 0.0 109.565 168.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 55.6 mttp -70.78 -35.08 72.41 Favored 'General case' 0 C--N 1.348 0.51 0 CA-C-N 119.236 0.926 . . . . 0.0 110.285 167.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.91 -35.15 75.94 Favored 'General case' 0 C--O 1.22 -0.497 0 CA-C-N 119.132 0.878 . . . . 0.0 110.266 169.559 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -63.56 -44.63 93.56 Favored 'General case' 0 CA--C 1.531 0.22 0 O-C-N 120.99 -1.069 . . . . 0.0 110.394 174.62 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -58.92 -40.81 85.7 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 118.644 0.656 . . . . 0.0 110.893 171.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -62.15 -40.17 95.07 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.648 0.779 . . . . 0.0 111.387 173.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -63.01 -42.96 99.95 Favored 'General case' 0 CA--C 1.529 0.158 0 O-C-N 120.848 -1.158 . . . . 0.0 109.743 175.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 80.9 mt -64.22 -43.18 95.78 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 123.184 0.593 . . . . 0.0 110.199 -178.42 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.06 -39.54 90.18 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 119.479 -0.296 . . . . 0.0 110.577 174.852 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 10.8 mmp_? -67.52 -29.62 69.07 Favored 'General case' 0 C--N 1.342 0.259 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 179.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 81.3 mttt -69.38 47.46 0.07 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.631 1.572 . . . . 0.0 110.943 168.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 59.7 p -145.33 175.92 9.94 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 127.121 2.169 . . . . 0.0 109.044 174.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -63.61 72.81 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 127.075 2.15 . . . . 0.0 112.207 -177.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 49.6 m -80.82 63.65 5.3 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 126.667 1.987 . . . . 0.0 110.741 -169.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 59.3 mtmt . . . . . 0 N--CA 1.465 0.31 0 C-N-CA 125.184 1.394 . . . . 0.0 110.685 -178.552 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.0 mtt . . . . . 0 C--O 1.239 0.523 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -63.75 159.09 43.08 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.368 2.045 . . . . 0.0 110.321 172.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 96.0 mm-40 -129.41 163.03 26.71 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 125.359 1.463 . . . . 0.0 110.281 -169.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 22.8 ptmt -145.78 -178.57 6.17 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 125.18 1.392 . . . . 0.0 110.201 178.065 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -135.69 88.75 23.08 Favored Pre-proline 0 CA--C 1.538 0.481 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 168.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -60.27 -32.9 94.86 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 123.747 2.965 . . . . 0.0 112.802 -171.208 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 96.3 m -94.14 -12.19 28.9 Favored 'General case' 0 N--CA 1.437 -1.099 0 C-N-CA 124.475 1.11 . . . . 0.0 113.144 -168.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 18.8 tp60 -61.38 -26.79 68.07 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 122.756 0.422 . . . . 0.0 110.833 177.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 51.9 tptt -60.05 -57.7 11.69 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.451 0.7 . . . . 0.0 109.807 168.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -60.28 -37.52 80.73 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 122.983 0.513 . . . . 0.0 110.317 -176.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -60.43 -35.82 76.73 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.465 1.106 . . . . 0.0 113.037 172.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 75.8 m -64.07 -44.49 92.23 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 118.343 0.52 . . . . 0.0 110.396 169.351 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.4 mm-40 -64.1 -25.09 67.95 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 117.955 -1.022 . . . . 0.0 112.28 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 46.8 mm -56.44 -50.5 72.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.243 0 CA-C-N 119.964 1.256 . . . . 0.0 109.409 169.251 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 -60.78 -55.39 33.74 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 -175.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 48.1 mttt -69.94 -30.58 68.0 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 118.245 -0.884 . . . . 0.0 111.425 -172.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 17.3 t -57.14 -46.76 82.42 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 168.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.05 -45.95 89.48 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 118.49 -0.767 . . . . 0.0 110.354 179.025 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -58.28 -45.27 88.21 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 119.177 0.899 . . . . 0.0 111.282 174.235 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.07 -13.53 58.21 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.048 0.939 . . . . 0.0 113.306 175.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -124.38 9.04 8.46 Favored 'General case' 0 C--N 1.343 0.289 0 C-N-CA 124.425 1.09 . . . . 0.0 112.351 -172.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.6 m 57.83 40.45 26.04 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 122.464 1.126 . . . . 0.0 110.814 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.256 6.8 m-85 72.01 13.98 5.84 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 127.852 2.461 . . . . 0.0 114.44 168.781 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 66.1 mtm -70.23 85.6 0.57 Allowed 'General case' 0 N--CA 1.44 -0.931 0 C-N-CA 125.132 1.373 . . . . 0.0 109.723 169.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -53.37 -25.69 16.45 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.312 0.645 . . . . 0.0 111.381 170.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.1 m -52.31 -38.86 59.62 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 126.744 2.018 . . . . 0.0 112.675 170.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.7 mmtm -74.17 -47.51 35.33 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.369 1.068 . . . . 0.0 108.69 173.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.2 m -71.71 0.89 7.72 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 124.892 1.277 . . . . 0.0 113.281 -174.496 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 51.6 mm-40 -54.72 -28.26 46.8 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 119.652 1.114 . . . . 0.0 110.242 166.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.59 -56.65 19.44 Favored 'General case' 0 C--N 1.346 0.441 0 C-N-CA 125.789 1.636 . . . . 0.0 111.906 171.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 13.4 p -75.77 -28.34 19.31 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.835 0 C-N-CA 123.288 0.635 . . . . 0.0 110.002 -174.113 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 60.0 mt -61.91 -45.85 97.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 N-CA-C 106.564 -1.643 . . . . 0.0 106.564 168.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.92 -38.41 70.24 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 119.202 0.91 . . . . 0.0 112.284 171.129 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -70.26 -37.85 74.98 Favored 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 119.354 -0.938 . . . . 0.0 110.085 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.413 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -65.28 -30.81 71.71 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 124.673 1.189 . . . . 0.0 108.834 174.957 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.0 mmt-85 -69.96 -49.89 47.31 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -61.02 -35.43 76.85 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-N 114.895 -1.048 . . . . 0.0 110.698 177.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 51.0 t -61.81 -57.17 12.89 Favored 'General case' 0 C--O 1.219 -0.551 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 168.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 35.4 t -58.39 -44.29 88.89 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 123.856 0.862 . . . . 0.0 112.144 -169.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.41 -1.21 10.01 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 124.03 0.932 . . . . 0.0 113.296 -178.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.526 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 15.5 tt0 -83.87 -8.85 59.1 Favored 'General case' 0 N--CA 1.444 -0.764 0 C-N-CA 124.435 1.094 . . . . 0.0 111.105 176.902 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.526 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 90.6 m-85 -138.97 158.02 70.49 Favored Pre-proline 0 N--CA 1.441 -0.894 0 C-N-CA 124.979 1.312 . . . . 0.0 112.106 -166.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -69.86 111.06 2.73 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 N-CA-C 104.968 -2.743 . . . . 0.0 104.968 165.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 64.3 pttt -42.01 -32.57 0.46 Allowed 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 117.964 2.579 . . . . 0.0 117.964 -166.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -56.47 -15.76 12.95 Favored Glycine 0 CA--C 1.538 1.509 0 CA-C-N 119.468 1.031 . . . . 0.0 114.177 172.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 5.0 tpm_? -54.05 -24.74 18.31 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 127.583 2.353 . . . . 0.0 112.132 168.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.3 t -146.76 137.74 24.05 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-O 122.73 1.252 . . . . 0.0 111.82 -170.392 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 18.7 t -66.84 -53.71 31.98 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.677 0 CA-C-N 113.491 -1.686 . . . . 0.0 108.487 177.172 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 3.8 m -60.26 -46.08 95.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-O 118.47 -0.776 . . . . 0.0 109.415 -178.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 41.9 t -63.31 -30.22 71.39 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.125 1.37 . . . . 0.0 109.943 -178.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 52.3 m -68.45 -27.48 66.21 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.186 0.595 . . . . 0.0 111.277 172.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -71.08 -40.42 61.98 Favored Glycine 0 N--CA 1.473 1.113 0 CA-C-O 124.781 2.323 . . . . 0.0 110.752 167.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.413 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 2.0 t80 -77.54 -35.88 52.87 Favored 'General case' 0 N--CA 1.41 -2.468 0 CA-C-N 111.22 -2.49 . . . . 0.0 116.677 -163.214 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -65.61 -28.09 68.88 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 118.258 -0.877 . . . . 0.0 110.909 169.363 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.51 -42.5 87.21 Favored 'General case' 0 C--N 1.346 0.433 0 CA-C-N 119.731 1.151 . . . . 0.0 109.367 168.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -58.09 -46.94 84.66 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.51 0.724 . . . . 0.0 110.765 174.055 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 48.3 tt0 -64.24 -45.63 87.33 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 125.903 1.681 . . . . 0.0 109.93 -176.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -60.15 -42.26 94.53 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.803 0.841 . . . . 0.0 110.634 174.513 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 37.4 tp10 -60.68 -41.67 95.59 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.277 0.489 . . . . 0.0 111.254 170.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -66.16 -29.78 70.14 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-O 117.832 -1.08 . . . . 0.0 111.821 -178.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 95.0 mt -53.15 -40.48 64.33 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 119.485 1.039 . . . . 0.0 110.738 171.167 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 17.8 p -66.1 -49.62 66.91 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.451 0.7 . . . . 0.0 110.325 178.421 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 14.5 ttp180 -53.61 -48.03 69.66 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.889 0.876 . . . . 0.0 110.39 175.252 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -76.07 -0.12 20.73 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 125.438 1.495 . . . . 0.0 114.923 -178.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 34.1 m -104.41 -8.38 19.21 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 127.467 2.307 . . . . 0.0 114.179 171.146 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . 50.47 39.86 21.83 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 129.518 3.127 . . . . 0.0 111.889 -173.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 34.8 m -160.97 147.98 15.24 Favored 'General case' 0 C--O 1.232 0.137 0 C-N-CA 124.352 1.061 . . . . 0.0 108.604 171.137 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 73.5 mttt . . . . . 0 N--CA 1.453 -0.288 0 C-N-CA 125.151 1.381 . . . . 0.0 109.219 -171.466 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.5 tpt . . . . . 0 CA--C 1.539 0.541 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -74.13 67.95 5.04 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 124.022 3.148 . . . . 0.0 110.31 175.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -63.21 135.75 57.3 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.862 0.865 . . . . 0.0 110.264 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 56.2 mtmt -68.67 -10.62 57.31 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 170.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -145.01 95.65 5.13 Favored Pre-proline 0 C--N 1.321 -0.656 0 C-N-CA 128.259 2.624 . . . . 0.0 108.358 173.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_exo -54.97 -30.59 70.1 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 125.175 3.916 . . . . 0.0 113.639 -172.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 91.6 m -97.74 -11.87 22.93 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 125.83 1.652 . . . . 0.0 113.261 -169.026 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 23.1 tp60 -62.52 -26.83 68.76 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 118.194 0.452 . . . . 0.0 110.722 -178.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 51.5 tttm -58.4 -56.09 26.65 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 123.605 0.762 . . . . 0.0 110.497 169.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -62.73 -44.53 95.97 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.3 0.64 . . . . 0.0 109.667 -176.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -52.98 -38.76 62.49 Favored 'General case' 0 N--CA 1.462 0.171 0 C-N-CA 125.056 1.343 . . . . 0.0 113.218 173.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 66.4 m -60.03 -44.09 94.86 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 120.162 -0.615 . . . . 0.0 110.333 172.252 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -66.75 -27.59 67.73 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 117.324 -1.322 . . . . 0.0 113.196 -179.276 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.8 mp -55.88 -48.82 77.87 Favored 'Isoleucine or valine' 0 C--N 1.343 0.294 0 CA-C-N 121.037 1.744 . . . . 0.0 109.598 169.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -59.91 -55.98 27.41 Favored 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 24.3 mmtm -68.86 -31.56 70.61 Favored 'General case' 0 CA--C 1.522 -0.098 0 CA-C-O 118.527 -0.749 . . . . 0.0 112.004 -171.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 27.6 t -55.04 -47.01 75.34 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 169.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.54 -45.44 91.78 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-O 118.435 -0.793 . . . . 0.0 110.463 179.248 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -57.97 -46.56 84.95 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 119.261 0.937 . . . . 0.0 111.007 174.24 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.62 -14.86 59.86 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.044 0.937 . . . . 0.0 113.365 176.335 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 -120.8 8.34 10.55 Favored 'General case' 0 C--N 1.343 0.298 0 C-N-CA 124.334 1.054 . . . . 0.0 112.056 -174.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.5 m 57.56 40.75 26.64 Favored 'General case' 0 C--N 1.345 0.406 0 CA-C-O 122.511 1.148 . . . . 0.0 110.78 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.269 6.9 m-85 72.59 14.39 5.17 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 128.045 2.538 . . . . 0.0 114.48 168.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 69.5 mtm -70.08 82.39 0.5 Allowed 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 125.13 1.372 . . . . 0.0 109.941 169.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -52.97 -24.44 9.4 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.637 1.175 . . . . 0.0 111.164 169.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.0 m -51.4 -44.12 62.12 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 126.107 1.763 . . . . 0.0 112.201 169.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.3 mmtt -73.11 -47.77 41.44 Favored 'General case' 0 C--O 1.232 0.182 0 C-N-CA 124.634 1.174 . . . . 0.0 108.963 176.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.0 m -69.51 0.61 5.01 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 124.648 1.179 . . . . 0.0 113.073 -176.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 52.4 mm-40 -54.9 -30.27 57.91 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 119.887 1.221 . . . . 0.0 110.8 166.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.01 -54.79 43.12 Favored 'General case' 0 C--N 1.344 0.367 0 C-N-CA 124.702 1.201 . . . . 0.0 111.463 173.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.0 p -75.56 -31.02 22.63 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.727 0 C-N-CA 122.871 0.468 . . . . 0.0 110.405 -174.403 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 69.1 mt -59.03 -46.32 91.79 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 N-CA-C 106.345 -1.724 . . . . 0.0 106.345 168.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.71 -26.48 61.82 Favored 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 121.011 -1.056 . . . . 0.0 113.281 173.706 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -76.49 -37.76 56.32 Favored 'General case' 0 N--CA 1.432 -1.356 0 C-N-CA 119.846 -0.742 . . . . 0.0 110.277 175.16 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.402 ' HB3' ' CE2' ' A' ' 53' ' ' PHE . 2.8 mt -62.6 -32.37 73.36 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-O 117.778 -1.106 . . . . 0.0 109.514 169.5 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.5 mmt180 -62.79 -53.8 48.75 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 120.163 1.347 . . . . 0.0 108.195 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 54.6 mttp -64.2 -34.44 78.1 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.177 -178.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 47.5 t -63.25 -51.57 65.63 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 110.105 -0.332 . . . . 0.0 110.105 169.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 45.5 t -65.05 -47.77 76.2 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 124.673 1.189 . . . . 0.0 111.84 -169.065 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.93 -1.02 6.35 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 115.551 -0.75 . . . . 0.0 112.331 -175.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.533 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 12.0 tt0 -80.28 -11.66 59.7 Favored 'General case' 0 N--CA 1.443 -0.821 0 C-N-CA 125.94 1.696 . . . . 0.0 110.999 176.643 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.533 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 84.9 m-85 -136.42 158.03 74.21 Favored Pre-proline 0 N--CA 1.439 -0.99 0 C-N-CA 125.449 1.499 . . . . 0.0 111.243 -167.814 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -68.25 109.0 1.89 Allowed 'Trans proline' 0 N--CA 1.455 -0.771 0 N-CA-C 104.295 -3.002 . . . . 0.0 104.295 165.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.51 -36.49 0.39 Allowed 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 117.739 2.496 . . . . 0.0 117.739 -165.668 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.2 -14.72 12.42 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 124.55 1.071 . . . . 0.0 114.234 174.531 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 35.6 tpt85 -51.99 -33.2 37.12 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 126.986 2.114 . . . . 0.0 111.542 168.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.2 t -136.92 139.53 41.63 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-O 122.428 1.109 . . . . 0.0 110.625 -168.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 15.3 t -68.15 -54.08 24.71 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.695 0 CA-C-N 114.016 -1.447 . . . . 0.0 108.362 177.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 6.8 m -62.48 -42.42 95.67 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.119 -176.267 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 36.7 t -64.06 -32.37 73.89 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.634 1.574 . . . . 0.0 110.284 177.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.0 m -69.57 -26.04 64.28 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.83 -0.544 . . . . 0.0 111.131 171.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.91 -32.05 66.64 Favored Glycine 0 C--N 1.344 0.985 0 CA-C-O 123.427 1.571 . . . . 0.0 111.266 167.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.402 ' CE2' ' HB3' ' A' ' 35' ' ' LEU . 1.2 t80 -80.57 -43.23 20.97 Favored 'General case' 0 N--CA 1.417 -2.097 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 -164.206 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 25.6 mm-40 -67.51 -24.25 65.55 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 119.634 -0.826 . . . . 0.0 110.4 171.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 58.4 mttp -69.73 -37.76 76.63 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 120.998 -1.064 . . . . 0.0 109.49 166.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -62.17 -33.72 75.05 Favored 'General case' 0 C--O 1.22 -0.469 0 O-C-N 121.659 -0.651 . . . . 0.0 111.403 170.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 40.6 tp10 -63.27 -45.52 91.1 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 120.054 1.297 . . . . 0.0 109.403 174.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.54 -41.31 85.24 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 119.219 -0.42 . . . . 0.0 110.524 173.264 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -58.87 -50.82 72.57 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 118.627 0.649 . . . . 0.0 110.74 173.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -59.54 -37.75 79.24 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 123.464 0.706 . . . . 0.0 110.198 -178.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 55.6 mt -64.01 -26.97 68.81 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 118.236 -0.888 . . . . 0.0 112.175 176.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 29.0 p -65.25 -49.05 71.11 Favored 'General case' 0 C--N 1.344 0.342 0 CA-C-N 119.912 1.233 . . . . 0.0 110.047 169.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 13.0 mtm180 -65.16 -32.78 74.64 Favored 'General case' 0 C--N 1.339 0.11 0 C-N-CA 123.499 0.719 . . . . 0.0 111.322 -178.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? 40.66 40.94 1.02 Allowed 'General case' 0 C--N 1.344 0.361 0 C-N-CA 127.77 2.428 . . . . 0.0 111.785 -169.51 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.3 m -175.76 176.43 1.86 Allowed 'General case' 0 C--O 1.239 0.506 0 C-N-CA 127.799 2.44 . . . . 0.0 108.292 -177.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -63.91 153.68 36.2 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.017 0.927 . . . . 0.0 110.467 169.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 35.9 p -64.31 108.47 1.61 Allowed 'General case' 0 C--O 1.239 0.505 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 169.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 60.6 mtpt . . . . . 0 N--CA 1.464 0.236 0 C-N-CA 123.542 0.737 . . . . 0.0 110.426 174.119 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 mmt . . . . . 0 CA--C 1.538 0.51 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -56.54 156.11 23.45 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.711 2.274 . . . . 0.0 112.749 177.236 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 8.8 mp0 -69.16 17.9 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 127.722 2.409 . . . . 0.0 114.399 -172.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 55.6 tptt -141.41 136.26 31.19 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 126.263 1.825 . . . . 0.0 107.82 176.255 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -94.27 104.26 13.22 Favored Pre-proline 0 N--CA 1.447 -0.588 0 N-CA-C 105.941 -1.874 . . . . 0.0 105.941 169.033 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -54.7 -34.75 85.13 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 124.497 3.465 . . . . 0.0 112.664 -170.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 77.5 m -94.48 -13.77 25.82 Favored 'General case' 0 N--CA 1.433 -1.319 0 C-N-CA 125.54 1.536 . . . . 0.0 113.03 -169.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 26.2 tp60 -61.85 -25.28 67.43 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 118.754 0.707 . . . . 0.0 111.224 -179.136 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 51.8 tttm -59.53 -56.62 19.71 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.766 1.226 . . . . 0.0 110.166 169.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -63.61 -38.23 90.34 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.73 0.812 . . . . 0.0 110.203 -177.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.99 -42.17 72.14 Favored 'General case' 0 C--N 1.339 0.148 0 C-N-CA 124.901 1.28 . . . . 0.0 112.816 171.18 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 82.0 m -57.56 -46.48 83.89 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.29 172.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -62.99 -25.44 68.38 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 117.84 -1.076 . . . . 0.0 112.253 -178.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 34.6 mm -57.15 -54.47 29.98 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.378 0 CA-C-N 120.019 1.281 . . . . 0.0 109.235 172.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 36.7 mm-40 -58.18 -54.47 46.65 Favored 'General case' 0 N--CA 1.443 -0.816 0 O-C-N 124.18 0.925 . . . . 0.0 108.934 -178.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -66.5 -32.68 74.18 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 118.925 -1.11 . . . . 0.0 111.693 -175.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 25.2 t -56.2 -48.89 75.53 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 119.443 1.02 . . . . 0.0 108.902 169.397 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.73 -46.8 86.55 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 123.244 0.618 . . . . 0.0 110.487 179.826 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -57.11 -45.92 83.04 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.977 0.911 . . . . 0.0 111.199 174.35 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.54 -12.4 52.5 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.18 0.992 . . . . 0.0 113.424 175.3 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 52.2 m-80 -124.67 8.83 8.27 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.688 1.195 . . . . 0.0 112.187 -173.13 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.1 m 57.93 40.31 25.85 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.646 1.112 . . . . 0.0 110.979 179.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.265 6.9 m-85 72.17 14.05 5.66 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 127.817 2.447 . . . . 0.0 114.619 168.846 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 64.5 mtm -69.47 86.52 0.44 Allowed 'General case' 0 N--CA 1.44 -0.964 0 C-N-CA 125.127 1.371 . . . . 0.0 109.962 169.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -53.5 -26.12 19.42 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.252 1.021 . . . . 0.0 111.21 169.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.5 m -57.05 -32.13 65.89 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 127.497 2.319 . . . . 0.0 113.514 170.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.5 mmtm -79.62 -45.55 18.89 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.251 1.02 . . . . 0.0 108.769 171.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 81.2 m -73.88 9.0 1.67 Allowed 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 125.675 1.59 . . . . 0.0 113.709 -175.117 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.589 HE22 ' NH2' ' A' ' 63' ' ' ARG . 59.9 mm-40 -53.16 -38.14 62.48 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.425 -0.797 . . . . 0.0 110.737 168.049 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.31 -50.11 74.94 Favored 'General case' 0 C--N 1.342 0.242 0 C-N-CA 123.666 0.786 . . . . 0.0 111.631 178.21 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.7 p -75.13 -28.4 20.68 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.841 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.741 -175.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 55.4 mt -61.19 -50.14 81.72 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.637 0 N-CA-C 106.852 -1.536 . . . . 0.0 106.852 169.003 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -55.23 -27.81 48.83 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 123.819 0.848 . . . . 0.0 111.139 176.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -74.66 -43.29 56.02 Favored 'General case' 0 N--CA 1.441 -0.91 0 O-C-N 121.75 -0.594 . . . . 0.0 112.421 174.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.6 mt -62.14 -30.38 71.0 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 119.393 0.997 . . . . 0.0 110.547 170.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.9 ttt-85 -64.78 -58.88 5.04 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 126.433 1.893 . . . . 0.0 110.155 178.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.7 ptmt -65.94 -27.98 68.57 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.796 -179.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 47.7 t -65.76 -51.44 59.16 Favored 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 168.422 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.1 t -62.9 -48.78 77.49 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.435 0.694 . . . . 0.0 112.186 -169.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.48 -2.81 5.07 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 124.176 0.99 . . . . 0.0 112.608 -176.39 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.534 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 14.2 tt0 -79.26 -12.15 59.95 Favored 'General case' 0 N--CA 1.441 -0.883 0 C-N-CA 125.57 1.548 . . . . 0.0 111.032 175.677 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.534 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 83.9 m-85 -135.31 159.22 72.6 Favored Pre-proline 0 N--CA 1.442 -0.833 0 C-N-CA 125.032 1.333 . . . . 0.0 111.801 -167.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -69.19 115.14 3.87 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 N-CA-C 104.926 -2.759 . . . . 0.0 104.926 165.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.433 ' H ' ' HE2' ' A' ' 44' ' ' LYS . 0.3 OUTLIER -38.6 -44.39 0.97 Allowed 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 116.234 1.939 . . . . 0.0 116.234 -166.417 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -56.89 -12.36 6.87 Favored Glycine 0 CA--C 1.535 1.327 0 C-N-CA 124.842 1.21 . . . . 0.0 114.328 178.105 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 34.8 tpt85 -54.28 -34.24 60.4 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 127.01 2.124 . . . . 0.0 111.91 169.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.5 t -143.23 142.13 31.3 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 122.344 1.068 . . . . 0.0 111.055 -168.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 6.5 t -70.03 -56.39 11.45 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 CA-C-N 114.257 -1.338 . . . . 0.0 108.84 -179.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.2 m -60.23 -37.56 74.06 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 122.927 0.491 . . . . 0.0 110.581 -177.037 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 8.1 t -69.37 -38.29 77.97 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.278 1.031 . . . . 0.0 109.919 177.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 44.5 m -65.04 -27.07 68.55 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.605 -0.685 . . . . 0.0 110.506 171.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.61 -25.61 75.42 Favored Glycine 0 C--N 1.343 0.959 0 CA-C-O 121.455 0.475 . . . . 0.0 112.5 169.66 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -80.69 -46.42 15.58 Favored 'General case' 0 N--CA 1.431 -1.412 0 N-CA-C 115.449 1.648 . . . . 0.0 115.449 -165.489 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -64.19 -17.94 64.01 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.925 173.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 10.5 mmpt? -81.71 -44.09 17.56 Favored 'General case' 0 C--N 1.348 0.52 0 C-N-CA 123.952 0.901 . . . . 0.0 110.595 165.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -56.76 -26.77 58.2 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.399 1.079 . . . . 0.0 111.549 173.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.7 -40.34 75.44 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.678 1.191 . . . . 0.0 109.657 173.497 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -66.41 -40.11 89.37 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.818 0.847 . . . . 0.0 109.883 176.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -53.9 -51.28 64.24 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 122.855 0.462 . . . . 0.0 110.659 169.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -63.13 -37.42 87.14 Favored 'General case' 0 C--N 1.327 -0.379 0 O-C-N 121.823 -0.548 . . . . 0.0 111.093 -175.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.9 tp -67.99 -43.67 78.39 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 126.331 1.852 . . . . 0.0 109.046 179.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -68.64 -31.26 70.28 Favored 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.902 -0.499 . . . . 0.0 110.963 176.236 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.589 ' NH2' HE22 ' A' ' 29' ' ' GLN . 15.4 ttm105 -76.02 -39.66 55.21 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 -176.107 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -66.55 178.74 1.18 Allowed 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 122.091 0.948 . . . . 0.0 113.331 -171.035 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 7.9 m -56.96 162.02 2.67 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.953 1.301 . . . . 0.0 111.437 174.161 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . 58.7 25.53 13.48 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.987 1.315 . . . . 0.0 112.902 -169.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 45.0 t -147.82 -179.65 7.05 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 128.424 2.689 . . . . 0.0 106.418 169.437 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 98.9 mttt . . . . . 0 N--CA 1.468 0.434 0 C-N-CA 127.383 2.273 . . . . 0.0 111.92 -178.965 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.9 mmt . . . . . 0 CA--C 1.538 0.49 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -71.35 135.14 26.1 Favored 'Trans proline' 0 N--CA 1.455 -0.769 0 C-N-CA 122.628 2.218 . . . . 0.0 110.185 170.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 11.4 mp0 -65.97 -26.77 67.71 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 126.6 1.96 . . . . 0.0 113.166 -168.262 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.7 ttpt -62.47 109.92 1.52 Allowed 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 107.663 -1.236 . . . . 0.0 107.663 171.353 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 18.1 t0 -93.96 103.29 9.99 Favored Pre-proline 0 N--CA 1.448 -0.551 0 C-N-CA 125.526 1.53 . . . . 0.0 108.185 -171.228 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -56.84 -34.48 96.86 Favored 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 123.979 3.119 . . . . 0.0 112.699 -170.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 69.2 m -94.24 -13.06 26.97 Favored 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 125.134 1.374 . . . . 0.0 112.914 -169.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 33.3 tp60 -62.72 -25.81 68.36 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 118.614 0.643 . . . . 0.0 110.827 179.206 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 50.7 tptt -60.11 -54.49 45.3 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 123.336 0.654 . . . . 0.0 110.21 169.238 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -62.98 -38.99 93.38 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.382 0.673 . . . . 0.0 109.907 -177.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -55.35 -45.02 76.48 Favored 'General case' 0 CA--C 1.518 -0.288 0 C-N-CA 124.954 1.302 . . . . 0.0 112.406 169.585 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 62.6 m -59.09 -40.34 85.0 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 118.119 0.418 . . . . 0.0 111.337 173.208 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -65.4 -21.52 66.68 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-O 117.776 -1.107 . . . . 0.0 112.679 176.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 28.0 mm -60.26 -50.37 80.51 Favored 'Isoleucine or valine' 0 C--N 1.342 0.28 0 CA-C-N 120.532 1.514 . . . . 0.0 109.388 171.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -58.75 -57.08 14.58 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 107.409 -1.33 . . . . 0.0 107.409 179.618 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 42.0 mtpt -68.35 -29.43 68.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 118.597 -0.716 . . . . 0.0 111.701 -169.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 25.7 t -56.15 -47.56 77.96 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 118.889 0.768 . . . . 0.0 109.186 169.024 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.41 -44.86 89.22 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 118.662 -0.685 . . . . 0.0 111.086 178.748 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.451 ' HA ' ' CE1' ' A' ' 23' ' ' TYR . 3.0 mp0 -58.37 -43.49 88.48 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 118.214 0.461 . . . . 0.0 111.428 173.665 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.99 -12.44 61.61 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 114.189 1.181 . . . . 0.0 114.189 176.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -125.87 15.01 8.02 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 119.673 1.124 . . . . 0.0 113.789 -168.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 18.1 m 60.56 35.1 20.16 Favored 'General case' 0 C--N 1.346 0.414 0 CA-C-N 120.619 1.554 . . . . 0.0 110.067 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.451 ' CE1' ' HA ' ' A' ' 19' ' ' GLN . 38.0 m-85 68.18 14.83 9.33 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 126.588 1.955 . . . . 0.0 113.737 167.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 62.9 mtm -74.54 89.72 2.2 Favored 'General case' 0 N--CA 1.439 -1.021 0 C-N-CA 126.048 1.739 . . . . 0.0 108.903 175.553 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -55.42 -23.77 26.74 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 119.165 -0.445 . . . . 0.0 111.405 172.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.4 m -52.33 -44.69 65.3 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 126.424 1.89 . . . . 0.0 112.098 170.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 62.8 mmtt -67.32 -47.65 69.9 Favored 'General case' 0 C--N 1.341 0.205 0 C-N-CA 123.832 0.853 . . . . 0.0 108.959 174.044 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 71.8 m -71.31 0.61 7.66 Favored 'General case' 0 N--CA 1.443 -0.791 0 C-N-CA 124.455 1.102 . . . . 0.0 112.945 -174.181 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 -56.59 -25.71 53.48 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 120.042 1.292 . . . . 0.0 111.101 167.186 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.06 -49.43 76.94 Favored 'General case' 0 C--N 1.345 0.381 0 C-N-CA 125.648 1.579 . . . . 0.0 112.174 169.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.4 p -82.67 -26.5 8.45 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.877 0 C-N-CA 123.917 0.887 . . . . 0.0 109.88 -174.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.5 mp -59.39 -47.06 91.95 Favored 'Isoleucine or valine' 0 C--N 1.348 0.541 0 N-CA-C 105.476 -2.046 . . . . 0.0 105.476 165.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.14 -32.53 62.16 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 123.12 0.568 . . . . 0.0 112.002 175.372 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -74.92 -39.88 61.17 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 119.951 -0.7 . . . . 0.0 111.463 178.361 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.6 mt -63.6 -35.48 80.65 Favored 'General case' 0 C--N 1.342 0.248 0 CA-C-N 119.217 0.917 . . . . 0.0 110.097 173.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.07 -60.46 3.46 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 125.104 1.361 . . . . 0.0 109.592 174.357 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -59.95 -38.54 82.77 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 113.728 -1.578 . . . . 0.0 110.235 -176.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 52.3 t -60.44 -52.06 66.84 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 122.937 0.495 . . . . 0.0 109.678 171.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 38.1 t -60.15 -43.36 95.82 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 121.09 0.472 . . . . 0.0 111.323 -172.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.04 -2.03 6.95 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 125.383 1.473 . . . . 0.0 113.378 179.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.525 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 23.3 tt0 -80.46 -8.81 59.69 Favored 'General case' 0 N--CA 1.442 -0.84 0 C-N-CA 123.882 0.873 . . . . 0.0 110.523 171.809 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.525 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 84.6 m-85 -141.07 167.12 18.37 Favored Pre-proline 0 N--CA 1.444 -0.765 0 C-N-CA 125.659 1.584 . . . . 0.0 111.458 -167.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -66.24 139.42 55.03 Favored 'Trans proline' 0 CA--C 1.538 0.698 0 N-CA-C 106.633 -2.103 . . . . 0.0 106.633 164.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.9 ptpp? -57.92 -26.69 62.55 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 115.115 1.524 . . . . 0.0 115.115 -168.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -80.69 0.62 85.66 Favored Glycine 0 CA--C 1.531 1.07 0 C-N-CA 124.24 0.924 . . . . 0.0 113.817 177.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 46.0 tpt85 -58.13 -35.97 72.27 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-N 119.368 1.584 . . . . 0.0 112.623 179.217 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -141.14 151.36 43.83 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 124.832 1.253 . . . . 0.0 110.038 -166.258 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 8.8 t -69.02 -56.68 11.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 123.938 0.895 . . . . 0.0 109.259 -177.37 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 9.2 m -59.73 -38.96 78.34 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 C-N-CA 122.954 0.502 . . . . 0.0 109.982 -179.09 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 11.2 t -68.39 -35.37 77.59 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.349 1.06 . . . . 0.0 109.837 179.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 48.9 m -64.36 -28.15 69.5 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 121.744 -0.598 . . . . 0.0 110.592 172.491 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -74.38 -25.14 71.28 Favored Glycine 0 C--N 1.344 1.012 0 CA-C-O 121.981 0.767 . . . . 0.0 111.809 172.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -81.9 -50.25 9.39 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.944 1.698 . . . . 0.0 114.447 -167.805 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -64.84 -22.23 66.95 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 115.591 -0.732 . . . . 0.0 110.434 174.18 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 63.6 tttm -70.68 -40.75 72.75 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 118.971 0.805 . . . . 0.0 110.445 167.086 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -56.09 -51.56 67.45 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 118.924 0.784 . . . . 0.0 109.719 170.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -63.76 -39.28 93.89 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.631 1.172 . . . . 0.0 110.95 -177.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -59.34 -47.05 86.86 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.74 0.816 . . . . 0.0 110.194 171.245 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -55.5 -47.13 76.68 Favored 'General case' 0 C--O 1.223 -0.294 0 CA-C-N 117.936 0.335 . . . . 0.0 110.349 173.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -62.51 -53.08 60.09 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 118.086 0.403 . . . . 0.0 110.754 -177.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.6 pp -67.19 -36.01 80.85 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 118.906 -0.569 . . . . 0.0 110.891 -173.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.11 -32.82 65.2 Favored 'General case' 0 C--N 1.341 0.239 0 CA-C-N 118.577 0.626 . . . . 0.0 111.299 176.318 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 25.0 ttm180 -75.9 -18.29 59.45 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 122.749 0.419 . . . . 0.0 111.814 174.573 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 21.3 tptp 57.35 37.19 27.93 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 128.03 2.532 . . . . 0.0 110.419 -175.03 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 23.0 t -157.24 -178.94 7.73 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 125.077 1.351 . . . . 0.0 109.034 -178.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -102.86 15.52 29.13 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.248 1.819 . . . . 0.0 111.727 168.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 29.3 m -70.56 39.23 0.05 Allowed 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 129.058 2.943 . . . . 0.0 112.359 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 12.2 ptpt . . . . . 0 CA--C 1.529 0.153 0 C-N-CA 126.41 1.884 . . . . 0.0 111.754 -178.659 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.4 ptm . . . . . 0 N--CA 1.443 -0.785 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -68.67 160.63 48.66 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 122.015 1.81 . . . . 0.0 110.095 169.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 20.8 mp0 -74.43 58.38 0.75 Allowed 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.465 1.906 . . . . 0.0 111.443 -175.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.417 ' HG3' ' H ' ' A' ' 5' ' ' ASP . 22.5 tptp 58.05 -177.08 0.07 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 126.821 2.048 . . . . 0.0 111.346 -173.811 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.417 ' H ' ' HG3' ' A' ' 4' ' ' LYS . 12.6 t0 -145.26 112.38 4.74 Favored Pre-proline 0 N--CA 1.448 -0.572 0 C-N-CA 129.678 3.191 . . . . 0.0 102.92 177.807 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -66.79 -35.88 26.03 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 123.555 2.837 . . . . 0.0 112.219 -169.494 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 87.5 m -94.77 -13.65 25.45 Favored 'General case' 0 N--CA 1.436 -1.155 0 C-N-CA 124.006 0.922 . . . . 0.0 113.45 -167.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.9 tm0? -51.21 -37.49 47.05 Favored 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 125.289 1.436 . . . . 0.0 111.489 171.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -57.23 -58.76 6.8 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 125.323 1.449 . . . . 0.0 110.039 171.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -62.39 -36.93 83.85 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.271 0.628 . . . . 0.0 110.774 -176.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -57.95 -38.91 76.84 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.617 1.167 . . . . 0.0 112.172 172.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 75.5 m -61.36 -43.06 99.51 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 118.399 0.545 . . . . 0.0 110.718 172.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -63.79 -22.33 66.86 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 117.95 -1.024 . . . . 0.0 112.328 178.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 23.9 mm -60.51 -53.7 45.28 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.334 0 CA-C-N 120.291 1.405 . . . . 0.0 109.277 171.571 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 16.8 mm-40 -61.35 -52.34 65.05 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 -178.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 40.7 mtpt -68.13 -30.75 69.97 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 118.29 -0.862 . . . . 0.0 111.354 -174.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 14.1 t -58.01 -47.94 81.53 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-N 119.298 0.954 . . . . 0.0 108.444 168.36 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.7 -47.02 83.55 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.287 0.635 . . . . 0.0 110.384 179.068 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -57.46 -44.9 85.19 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.918 0.887 . . . . 0.0 111.193 174.119 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.58 -12.76 59.37 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 175.016 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 47.9 m-80 -124.37 8.63 8.44 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 124.584 1.154 . . . . 0.0 112.308 -172.46 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 58.61 40.11 23.92 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 122.367 1.08 . . . . 0.0 110.915 179.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.258 7.1 m-85 71.98 13.98 5.87 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 127.883 2.473 . . . . 0.0 114.619 168.78 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 68.3 mtm -70.63 83.93 0.62 Allowed 'General case' 0 N--CA 1.443 -0.821 0 C-N-CA 125.128 1.371 . . . . 0.0 109.695 170.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -54.4 -23.26 15.03 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.687 0.795 . . . . 0.0 111.722 172.283 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.6 m -53.03 -40.87 64.21 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 126.013 1.725 . . . . 0.0 112.273 170.047 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 50.6 mmtt -70.81 -47.69 58.13 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 124.31 1.044 . . . . 0.0 108.809 174.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.6 m -73.12 1.37 9.25 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 124.711 1.205 . . . . 0.0 113.267 -173.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 76.0 mm-40 -54.41 -31.08 54.31 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 119.485 1.039 . . . . 0.0 110.488 167.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.69 -58.23 8.69 Favored 'General case' 0 C--N 1.345 0.39 0 C-N-CA 124.884 1.274 . . . . 0.0 111.463 174.096 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.8 p -74.6 -28.99 22.77 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.91 0 C-N-CA 123.981 0.913 . . . . 0.0 109.995 -173.243 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 58.1 mt -59.52 -48.99 85.29 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 N-CA-C 105.943 -1.873 . . . . 0.0 105.943 168.043 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.448 HE22 ' NH1' ' A' ' 36' ' ' ARG . 0.7 OUTLIER -61.1 -31.6 71.28 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 119.325 0.966 . . . . 0.0 113.097 175.572 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -68.49 -39.92 81.14 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 119.433 1.015 . . . . 0.0 110.089 175.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.33 -29.05 70.43 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 124.648 1.179 . . . . 0.0 108.774 176.037 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.448 ' NH1' HE22 ' A' ' 33' ' ' GLN . 10.3 mmt85 -69.68 -50.44 43.85 Favored 'General case' 0 CA--C 1.512 -0.505 0 CA-C-N 119.203 0.91 . . . . 0.0 108.556 -179.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 62.9 mmtt -63.07 -32.84 74.3 Favored 'General case' 0 C--O 1.235 0.296 0 O-C-N 123.849 0.718 . . . . 0.0 111.069 178.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.2 t -62.5 -54.59 37.71 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 169.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 46.5 t -62.88 -47.95 81.11 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 124.058 0.943 . . . . 0.0 111.936 -169.694 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.26 -0.95 5.28 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 124.59 1.156 . . . . 0.0 112.609 -177.467 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.464 ' HB3' ' CE2' ' A' ' 42' ' ' TYR . 2.1 tp-100 -79.13 -11.69 59.98 Favored 'General case' 0 N--CA 1.438 -1.073 0 C-N-CA 123.767 0.827 . . . . 0.0 111.463 172.106 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.464 ' CE2' ' HB3' ' A' ' 41' ' ' GLN . 68.0 m-85 -137.27 156.66 75.21 Favored Pre-proline 0 N--CA 1.443 -0.812 0 C-N-CA 123.972 0.909 . . . . 0.0 112.151 -167.146 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.8 121.5 8.56 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 N-CA-C 105.645 -2.483 . . . . 0.0 105.645 166.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -44.5 -40.52 5.67 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 116.306 1.965 . . . . 0.0 116.306 -166.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.44 -13.78 31.61 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 123.783 0.706 . . . . 0.0 113.657 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.06 -21.19 66.0 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.859 1.263 . . . . 0.0 112.449 171.093 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.8 t -142.84 137.03 29.33 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-O 122.988 1.375 . . . . 0.0 111.107 -176.44 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 19.3 t -66.98 -53.45 33.93 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.615 0 CA-C-N 113.852 -1.522 . . . . 0.0 108.926 -178.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 2.4 m -59.81 -46.65 93.45 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 -178.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 42.2 t -63.0 -30.65 71.77 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.952 1.301 . . . . 0.0 109.924 -176.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 64.5 m -68.0 -24.81 65.17 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 118.663 -0.684 . . . . 0.0 111.893 174.073 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -74.08 -40.22 43.31 Favored Glycine 0 N--CA 1.471 1.001 0 CA-C-O 124.288 2.049 . . . . 0.0 111.193 167.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -76.63 -37.67 55.97 Favored 'General case' 0 N--CA 1.411 -2.395 0 CA-C-N 111.055 -2.573 . . . . 0.0 116.848 -162.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -63.39 -26.08 68.58 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 119.651 -0.82 . . . . 0.0 110.766 169.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.2 mtmp? -70.49 -41.16 73.04 Favored 'General case' 0 C--N 1.348 0.523 0 CA-C-N 119.657 1.117 . . . . 0.0 110.403 170.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -56.18 -48.91 75.43 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.23 1.012 . . . . 0.0 109.816 173.127 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -62.53 -46.72 87.09 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 125.646 1.578 . . . . 0.0 110.488 -179.274 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -59.17 -41.74 89.13 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 122.67 0.388 . . . . 0.0 110.755 173.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -60.49 -43.52 96.93 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 118.368 0.531 . . . . 0.0 110.942 173.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -64.79 -33.48 76.09 Favored 'General case' 0 C--N 1.329 -0.285 0 O-C-N 121.07 -1.019 . . . . 0.0 111.2 179.4 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 47.6 mt -72.64 -40.17 66.6 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 123.961 0.904 . . . . 0.0 109.527 178.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -63.62 -38.68 92.05 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 118.818 -0.61 . . . . 0.0 110.735 172.43 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 76.7 mmt-85 -62.04 -50.54 71.59 Favored 'General case' 0 C--N 1.347 0.489 0 CA-C-N 119.338 0.972 . . . . 0.0 110.291 172.502 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.95 59.83 1.31 Allowed 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.773 1.229 . . . . 0.0 110.511 177.863 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 59.8 p -137.29 177.12 8.11 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.519 1.528 . . . . 0.0 110.037 177.299 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -141.71 22.54 2.13 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.592 1.157 . . . . 0.0 111.76 171.113 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 28.6 m -175.55 169.09 3.15 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 128.232 2.613 . . . . 0.0 107.758 178.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp . . . . . 0 CA--C 1.529 0.164 0 C-N-CA 123.302 0.641 . . . . 0.0 109.555 174.704 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.1 mtt . . . . . 0 CA--C 1.544 0.738 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -55.48 112.43 1.05 Allowed 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 123.394 2.73 . . . . 0.0 111.35 -177.202 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 16.8 mp0 -55.33 -30.64 60.65 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.657 1.183 . . . . 0.0 113.395 -168.008 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.6 mmmt -104.2 0.87 29.96 Favored 'General case' 0 CA--C 1.515 -0.366 0 N-CA-C 115.424 1.638 . . . . 0.0 115.424 178.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -145.55 82.9 9.27 Favored Pre-proline 0 C--N 1.323 -0.564 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 168.574 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -51.62 -36.37 60.49 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 124.48 3.453 . . . . 0.0 112.37 -169.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 95.4 m -92.97 -8.73 42.25 Favored 'General case' 0 N--CA 1.436 -1.156 0 C-N-CA 126.538 1.935 . . . . 0.0 113.279 -169.152 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 29.4 tp60 -62.89 -24.97 68.08 Favored 'General case' 0 N--CA 1.446 -0.655 0 O-C-N 121.596 -0.69 . . . . 0.0 110.659 178.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -57.63 -56.78 17.52 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 123.424 0.689 . . . . 0.0 109.594 168.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 20.2 mp0 -59.06 -43.39 91.71 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 123.646 0.778 . . . . 0.0 110.203 -177.654 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.23 -44.11 71.44 Favored 'General case' 0 C--N 1.339 0.133 0 C-N-CA 124.404 1.081 . . . . 0.0 112.209 174.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 97.4 m -60.55 -45.64 93.14 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 117.498 0.135 . . . . 0.0 110.915 172.101 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 61.0 mm-40 -63.16 -23.65 67.53 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 117.577 -1.202 . . . . 0.0 112.745 178.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 43.7 mm -57.05 -54.16 33.76 Favored 'Isoleucine or valine' 0 C--N 1.342 0.254 0 CA-C-N 120.659 1.572 . . . . 0.0 109.233 172.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 34.7 mm-40 -58.75 -54.01 51.88 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 124.02 0.825 . . . . 0.0 109.086 -179.205 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.2 mptp? -66.81 -32.21 73.35 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 118.944 -1.102 . . . . 0.0 111.709 -174.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 24.7 t -56.42 -48.35 77.15 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 119.381 0.991 . . . . 0.0 108.841 169.029 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.32 -46.8 85.49 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 123.216 0.606 . . . . 0.0 110.628 179.297 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -56.97 -45.58 82.78 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.739 0.816 . . . . 0.0 111.205 174.021 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.95 -12.57 55.83 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.027 0.931 . . . . 0.0 113.437 175.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.7 m-80 -124.31 8.68 8.48 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.617 1.167 . . . . 0.0 112.228 -173.164 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 58.32 40.19 24.75 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 122.426 1.108 . . . . 0.0 110.913 179.619 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.255 6.9 m-85 71.98 13.64 5.92 Favored 'General case' 0 N--CA 1.445 -0.701 0 C-N-CA 127.817 2.447 . . . . 0.0 114.619 168.865 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 67.2 mtm -71.01 83.72 0.69 Allowed 'General case' 0 N--CA 1.44 -0.942 0 C-N-CA 125.144 1.378 . . . . 0.0 109.474 170.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -55.89 -22.11 23.9 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.949 0.9 . . . . 0.0 111.973 173.602 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 7.0 m -56.99 -34.18 67.87 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 126.728 2.011 . . . . 0.0 113.086 169.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 52.4 mmtt -74.89 -46.2 37.66 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 124.052 0.941 . . . . 0.0 108.74 171.813 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.3 m -73.73 6.13 3.45 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 125.133 1.373 . . . . 0.0 113.191 -174.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.586 HE22 ' NH2' ' A' ' 63' ' ' ARG . 40.0 mm-40 -54.93 -31.87 60.72 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 119.182 0.901 . . . . 0.0 110.139 167.138 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.33 -56.86 16.41 Favored 'General case' 0 C--N 1.345 0.391 0 C-N-CA 125.117 1.367 . . . . 0.0 111.433 174.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.7 p -73.69 -27.71 23.45 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 C-N-CA 123.843 0.857 . . . . 0.0 110.083 -174.308 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 63.6 mt -61.03 -49.53 84.34 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 N-CA-C 106.605 -1.628 . . . . 0.0 106.605 168.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -55.98 -30.84 62.37 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 118.915 0.78 . . . . 0.0 111.849 174.318 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -69.14 -46.19 68.24 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 118.862 0.756 . . . . 0.0 111.632 173.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.401 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.5 mt -55.74 -34.03 64.81 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-N 119.005 0.821 . . . . 0.0 109.577 172.384 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -70.39 -54.72 11.3 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 125.086 1.355 . . . . 0.0 111.648 -176.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 62.3 mttm -61.45 -34.7 75.88 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 124.728 1.211 . . . . 0.0 110.779 176.425 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 50.8 t -63.82 -51.01 66.65 Favored 'General case' 0 N--CA 1.444 -0.77 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 169.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 53.9 t -61.77 -50.07 73.82 Favored 'General case' 0 CA--C 1.515 -0.379 0 C-N-CA 123.446 0.698 . . . . 0.0 112.084 -172.029 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.51 -1.8 5.53 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 124.629 1.172 . . . . 0.0 111.98 -176.139 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.442 ' HB3' ' CE2' ' A' ' 42' ' ' TYR . 2.3 tp-100 -79.64 -8.12 58.99 Favored 'General case' 0 N--CA 1.438 -1.042 0 C-N-CA 124.589 1.156 . . . . 0.0 111.123 174.2 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.442 ' CE2' ' HB3' ' A' ' 41' ' ' GLN . 79.2 m-85 -141.6 163.1 43.23 Favored Pre-proline 0 N--CA 1.441 -0.913 0 C-N-CA 125.446 1.498 . . . . 0.0 111.024 -168.264 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -67.81 135.46 35.54 Favored 'Trans proline' 0 CA--C 1.537 0.638 0 N-CA-C 106.35 -2.212 . . . . 0.0 106.35 165.658 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -55.1 -29.47 57.7 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 114.889 1.44 . . . . 0.0 114.889 -168.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -67.86 -9.17 55.78 Favored Glycine 0 CA--C 1.533 1.201 0 CA-C-O 119.062 -0.855 . . . . 0.0 113.922 177.278 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 41.4 tpt85 -60.89 -31.97 71.44 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 119.171 1.486 . . . . 0.0 112.221 175.207 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.4 t -144.79 138.19 26.94 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 123.538 0.735 . . . . 0.0 110.273 -168.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 11.0 t -63.59 -56.75 15.15 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 CA-C-N 114.748 -1.115 . . . . 0.0 108.743 -178.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.2 m -59.01 -40.7 81.28 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 123.571 0.748 . . . . 0.0 110.438 -176.281 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 6.9 t -66.64 -37.84 85.67 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.82 1.248 . . . . 0.0 109.648 179.016 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 27.1 p -65.56 -25.07 67.26 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 121.788 -0.57 . . . . 0.0 111.051 174.207 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.89 -26.77 68.26 Favored Glycine 0 C--N 1.346 1.095 0 CA-C-O 121.759 0.644 . . . . 0.0 112.423 170.049 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.401 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.4 OUTLIER -80.43 -46.51 15.84 Favored 'General case' 0 N--CA 1.429 -1.523 0 N-CA-C 116.043 1.868 . . . . 0.0 116.043 -164.641 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 71.2 mt-10 -61.86 -21.72 64.91 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.54 172.291 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -81.01 -44.33 18.25 Favored 'General case' 0 C--N 1.347 0.495 0 CA-C-N 119.242 0.928 . . . . 0.0 110.926 167.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -56.37 -26.29 52.44 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.025 0.93 . . . . 0.0 111.224 174.635 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -54.38 -44.69 72.48 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 124.557 1.143 . . . . 0.0 109.908 174.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -69.59 -32.6 71.44 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.927 0.891 . . . . 0.0 110.669 178.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -61.89 -45.14 95.06 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 117.816 0.28 . . . . 0.0 110.546 169.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -67.47 -27.47 67.05 Favored 'General case' 0 C--O 1.226 -0.143 0 C-N-CA 123.755 0.822 . . . . 0.0 111.757 -176.136 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 91.2 mt -52.44 -23.3 5.86 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 118.53 -0.747 . . . . 0.0 112.87 171.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 72.9 p -58.89 -64.67 0.85 Allowed 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 119.505 1.048 . . . . 0.0 109.638 169.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.586 ' NH2' HE22 ' A' ' 29' ' ' GLN . 61.2 mtm-85 -56.83 -45.15 82.53 Favored 'General case' 0 C--O 1.228 -0.027 0 C-N-CA 125.095 1.358 . . . . 0.0 111.095 177.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 23.2 mmtp -81.58 53.62 2.16 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.103 1.361 . . . . 0.0 110.064 -176.291 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 77.4 p -138.12 173.79 11.25 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 125.204 1.402 . . . . 0.0 111.828 178.139 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.35 132.8 55.06 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.422 1.089 . . . . 0.0 110.623 -176.391 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 95.5 p 60.19 17.04 6.55 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 125.713 1.605 . . . . 0.0 114.979 -174.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 29.3 mtpp . . . . . 0 N--CA 1.45 -0.444 0 C-N-CA 126.332 1.853 . . . . 0.0 108.041 173.32 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 90.3 mmm . . . . . 0 CA--C 1.537 0.465 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -62.96 123.77 12.82 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 122.683 2.255 . . . . 0.0 109.36 173.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 90.7 mm-40 -77.67 57.82 1.7 Allowed 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 125.559 1.543 . . . . 0.0 111.672 -170.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -63.19 146.52 53.18 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.986 0.914 . . . . 0.0 110.122 178.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -93.97 99.52 3.74 Favored Pre-proline 0 N--CA 1.446 -0.667 0 N-CA-C 106.288 -1.745 . . . . 0.0 106.288 169.158 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -60.18 -37.23 84.9 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 123.211 2.607 . . . . 0.0 111.964 -171.229 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 93.5 m -92.01 -9.51 42.61 Favored 'General case' 0 N--CA 1.443 -0.791 0 C-N-CA 125.189 1.396 . . . . 0.0 113.047 -167.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 20.1 tp60 -59.53 -25.51 64.57 Favored 'General case' 0 N--CA 1.439 -0.993 0 CA-C-O 118.99 -0.529 . . . . 0.0 110.063 172.087 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 56.5 tptt -56.35 -61.68 2.24 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.895 1.278 . . . . 0.0 109.122 167.439 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 19.5 mp0 -57.91 -42.34 84.54 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 118.826 -0.607 . . . . 0.0 110.36 -177.431 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -56.56 -40.52 75.32 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.495 1.118 . . . . 0.0 112.388 174.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 96.6 m -64.63 -45.01 88.67 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 123.338 0.655 . . . . 0.0 111.27 170.234 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -63.76 -26.33 68.59 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-O 117.434 -1.269 . . . . 0.0 111.958 -179.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 12.1 mm -57.06 -50.11 77.42 Favored 'Isoleucine or valine' 0 C--N 1.34 0.192 0 CA-C-N 120.439 1.472 . . . . 0.0 109.036 170.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 47.2 mm-40 -60.18 -49.54 77.24 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 -174.127 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 26.8 mttp -71.71 -37.51 70.64 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 124.272 1.029 . . . . 0.0 111.943 -176.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 11.3 t -53.23 -43.34 67.21 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 108.463 -0.939 . . . . 0.0 108.463 169.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.01 -45.61 90.26 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 -178.075 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -64.57 -41.78 96.06 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 123.852 0.861 . . . . 0.0 110.521 179.11 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.22 -11.93 17.44 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.172 0.804 . . . . 0.0 113.172 171.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 55.4 m-80 -126.32 9.65 7.3 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.067 1.347 . . . . 0.0 112.257 -175.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 12.6 m 54.48 42.01 31.61 Favored 'General case' 0 C--N 1.345 0.389 0 CA-C-O 122.68 1.229 . . . . 0.0 111.983 -178.16 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.264 7.3 m-85 73.36 13.45 4.61 Favored 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 128.523 2.729 . . . . 0.0 114.526 168.046 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 66.7 mtm -69.6 85.02 0.44 Allowed 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 125.121 1.368 . . . . 0.0 109.761 169.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -54.46 -23.65 16.99 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.376 0.671 . . . . 0.0 111.538 171.09 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.1 m -52.73 -41.29 63.84 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 126.161 1.784 . . . . 0.0 112.151 170.082 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.3 mmtm -71.85 -47.8 50.54 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.28 1.032 . . . . 0.0 108.926 175.034 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.3 m -70.95 1.0 6.16 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 124.679 1.191 . . . . 0.0 112.919 -175.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 74.0 mm-40 -55.45 -29.53 58.84 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 119.635 1.107 . . . . 0.0 110.131 166.37 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.29 -59.25 5.21 Favored 'General case' 0 C--N 1.345 0.378 0 C-N-CA 124.946 1.298 . . . . 0.0 111.371 173.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 14.9 p -72.46 -29.15 30.18 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.819 0 C-N-CA 124.057 0.943 . . . . 0.0 109.909 -174.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 60.9 mt -60.69 -48.53 88.32 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 N-CA-C 106.263 -1.754 . . . . 0.0 106.263 169.077 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.41 HE22 ' NH1' ' A' ' 36' ' ' ARG . 0.9 OUTLIER -61.6 -28.99 69.75 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 119.637 1.108 . . . . 0.0 113.224 174.192 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 46.4 tt0 -67.11 -39.18 86.65 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 119.419 1.009 . . . . 0.0 109.973 172.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.438 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -60.07 -30.48 69.25 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 125.726 1.61 . . . . 0.0 109.084 175.294 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.41 ' NH1' HE22 ' A' ' 33' ' ' GLN . 18.9 mmt85 -71.89 -50.94 24.91 Favored 'General case' 0 C--N 1.343 0.292 0 C-N-CA 123.982 0.913 . . . . 0.0 108.567 -179.427 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -63.51 -29.78 71.0 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 124.755 1.222 . . . . 0.0 111.224 178.358 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 51.7 t -67.96 -55.44 12.73 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 167.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 44.3 t -59.61 -44.32 93.45 Favored 'General case' 0 C--N 1.328 -0.336 0 O-C-N 121.107 -0.995 . . . . 0.0 112.904 -170.253 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.25 -0.67 10.45 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 113.216 0.821 . . . . 0.0 113.216 -174.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.528 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 13.2 tt0 -93.62 -9.31 38.41 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 126.891 2.076 . . . . 0.0 111.914 -169.695 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.528 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 81.2 m-85 -133.84 163.08 53.72 Favored Pre-proline 0 N--CA 1.448 -0.537 0 C-N-CA 124.681 1.193 . . . . 0.0 111.625 -167.753 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -68.84 94.26 0.45 Allowed 'Trans proline' 0 N--CA 1.456 -0.723 0 N-CA-C 104.743 -2.83 . . . . 0.0 104.743 164.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.7 mptp? -39.08 -28.74 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 128.498 2.719 . . . . 0.0 117.898 -164.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -56.27 -17.11 16.82 Favored Glycine 0 CA--C 1.54 1.636 0 CA-C-N 120.033 1.288 . . . . 0.0 113.597 169.162 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -54.4 -24.1 18.47 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 127.965 2.506 . . . . 0.0 111.52 168.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.6 t -140.5 132.26 27.4 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-O 123.355 1.55 . . . . 0.0 113.33 -172.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 20.9 t -70.54 -52.23 30.8 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.717 0 CA-C-N 112.723 -2.035 . . . . 0.0 108.887 176.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.9 m -59.38 -45.49 93.39 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 CA-C-O 118.828 -0.606 . . . . 0.0 109.542 -179.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 35.1 t -62.88 -33.27 74.94 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.684 1.594 . . . . 0.0 109.953 -179.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 54.4 m -66.39 -25.19 66.66 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.24 0.616 . . . . 0.0 111.391 173.043 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.38 -47.57 28.22 Favored Glycine 0 N--CA 1.473 1.163 0 CA-C-O 124.527 2.182 . . . . 0.0 109.638 166.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.438 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 1.6 t80 -66.58 -36.6 83.02 Favored 'General case' 0 N--CA 1.408 -2.528 0 CA-C-N 110.917 -2.642 . . . . 0.0 116.325 -164.659 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -63.21 -23.04 67.25 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 118.281 -0.866 . . . . 0.0 111.634 173.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 55.6 mttp -66.67 -46.14 76.65 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 119.393 0.997 . . . . 0.0 109.368 169.168 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -60.34 -46.59 89.36 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.511 1.124 . . . . 0.0 110.734 175.149 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -65.49 -42.99 91.57 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.167 1.387 . . . . 0.0 109.845 -176.513 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 33.7 tp10 -61.08 -43.75 98.41 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 118.431 0.559 . . . . 0.0 110.728 173.316 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -57.85 -45.2 86.59 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 122.567 0.347 . . . . 0.0 110.794 173.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -68.33 -37.24 80.36 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.513 0.725 . . . . 0.0 111.474 -178.058 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 19.5 mt -59.28 -20.32 53.4 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 124.747 1.219 . . . . 0.0 112.481 179.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 52.7 p -56.91 -53.88 52.91 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.885 0.766 . . . . 0.0 110.078 169.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 7.1 tpm_? -80.94 -36.11 31.39 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 123.51 0.724 . . . . 0.0 111.804 -179.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -75.7 55.69 0.87 Allowed 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.206 1.002 . . . . 0.0 109.517 173.331 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.9 m -174.75 173.14 2.85 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 129.333 3.053 . . . . 0.0 107.755 176.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -153.22 173.89 14.96 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.43 1.492 . . . . 0.0 108.695 175.113 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 8.7 m -70.24 61.86 0.21 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.773 2.029 . . . . 0.0 112.623 -177.094 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt . . . . . 0 CA--C 1.531 0.225 0 C-N-CA 125.761 1.624 . . . . 0.0 110.477 -178.195 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.8 mmt . . . . . 0 C--O 1.238 0.458 0 CA-C-O 118.626 -0.702 . . . . 0.0 109.197 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -65.96 106.19 0.92 Allowed 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 123.467 2.778 . . . . 0.0 110.302 179.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 89.0 mm-40 -69.38 151.59 45.97 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 123.556 0.742 . . . . 0.0 110.459 179.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.2 mtmm -135.97 174.09 10.99 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.814 1.646 . . . . 0.0 109.922 -175.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -137.27 85.01 22.66 Favored Pre-proline 0 CA--C 1.536 0.428 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 168.09 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -55.9 -29.85 74.73 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 124.54 3.493 . . . . 0.0 113.325 -171.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 88.7 m -96.78 -12.62 23.42 Favored 'General case' 0 N--CA 1.433 -1.28 0 C-N-CA 125.922 1.689 . . . . 0.0 113.905 -168.504 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 18.9 tp60 -62.02 -24.7 67.22 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 117.98 0.355 . . . . 0.0 111.627 -176.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.4 ttpp -70.88 -45.86 63.63 Favored 'General case' 0 CA--C 1.532 0.275 0 O-C-N 121.522 -0.736 . . . . 0.0 111.043 173.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -63.26 -40.36 97.19 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.458 0.703 . . . . 0.0 109.892 178.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -53.15 -40.51 64.32 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 124.631 1.172 . . . . 0.0 113.046 169.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 72.2 m -58.71 -46.05 88.18 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 110.443 -0.206 . . . . 0.0 110.443 174.022 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -60.93 -27.9 68.55 Favored 'General case' 0 CA--C 1.528 0.127 0 CA-C-O 118.112 -0.947 . . . . 0.0 112.691 178.437 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 21.8 mm -57.92 -54.32 33.49 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.473 0 CA-C-N 119.444 1.02 . . . . 0.0 109.339 173.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 36.0 mm-40 -58.15 -55.14 38.78 Favored 'General case' 0 N--CA 1.444 -0.764 0 O-C-N 124.365 1.041 . . . . 0.0 108.864 -177.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.65 -32.96 74.62 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 118.209 -1.396 . . . . 0.0 112.045 -175.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 31.0 t -56.46 -47.5 79.04 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 119.483 1.038 . . . . 0.0 109.127 169.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.96 -46.57 87.74 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 123.59 0.756 . . . . 0.0 110.629 179.368 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -57.08 -44.2 82.89 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.878 0.871 . . . . 0.0 111.293 173.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.91 -11.81 57.41 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.039 0.935 . . . . 0.0 113.434 174.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 50.2 m-80 -126.42 9.47 7.21 Favored 'General case' 0 C--N 1.343 0.31 0 C-N-CA 124.507 1.123 . . . . 0.0 112.656 -172.543 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 14.8 m 58.12 40.51 25.06 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 122.445 1.117 . . . . 0.0 111.05 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.255 6.7 m-85 71.99 13.02 6.0 Favored 'General case' 0 N--CA 1.444 -0.736 0 C-N-CA 127.888 2.475 . . . . 0.0 114.791 168.448 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 63.4 mtm -69.61 86.92 0.47 Allowed 'General case' 0 N--CA 1.441 -0.91 0 C-N-CA 125.116 1.367 . . . . 0.0 109.917 170.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -56.05 -20.94 19.01 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.089 0.556 . . . . 0.0 111.7 170.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 6.4 m -58.25 -37.39 74.84 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 127.56 2.344 . . . . 0.0 113.014 169.333 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 56.9 mmtt -75.75 -48.68 20.8 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 124.252 1.021 . . . . 0.0 108.736 173.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 83.9 m -71.33 6.57 1.68 Allowed 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 125.338 1.455 . . . . 0.0 112.95 -177.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -52.14 -32.34 35.24 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 120.129 1.332 . . . . 0.0 111.914 169.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.56 -56.23 24.54 Favored 'General case' 0 C--N 1.342 0.282 0 C-N-CA 125.117 1.367 . . . . 0.0 111.649 173.035 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.8 p -75.49 -29.51 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.872 0 C-N-CA 124.004 0.922 . . . . 0.0 109.934 -174.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.5 mp -58.38 -49.35 82.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 N-CA-C 105.648 -1.982 . . . . 0.0 105.648 167.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.4 ' HA ' ' CG ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -59.75 -22.77 62.55 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 118.896 0.771 . . . . 0.0 112.778 177.987 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -76.82 -41.44 44.33 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 119.39 -0.924 . . . . 0.0 110.406 173.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.7 mt -62.8 -30.85 71.78 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 119.364 0.984 . . . . 0.0 110.667 170.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.4 ' CG ' ' HA ' ' A' ' 33' ' ' GLN . 25.2 mmt85 -62.4 -57.68 10.4 Favored 'General case' 0 C--N 1.339 0.135 0 CA-C-N 119.73 1.15 . . . . 0.0 108.307 176.266 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 20.4 pttm -69.62 -23.09 63.45 Favored 'General case' 0 C--O 1.234 0.241 0 O-C-N 123.484 0.49 . . . . 0.0 111.46 -175.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 46.7 t -68.21 -54.15 19.83 Favored 'General case' 0 N--CA 1.439 -1.0 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 166.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.0 t -61.55 -50.59 72.04 Favored 'General case' 0 CA--C 1.516 -0.362 0 C-N-CA 124.691 1.196 . . . . 0.0 112.912 -169.33 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.76 0.06 3.65 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.988 0.915 . . . . 0.0 112.82 -173.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.529 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 10.6 tt0 -84.58 -8.87 58.75 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 127.041 2.136 . . . . 0.0 111.378 179.075 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.529 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 81.5 m-85 -137.46 155.76 75.31 Favored Pre-proline 0 N--CA 1.439 -1.011 0 C-N-CA 126.813 2.045 . . . . 0.0 110.87 -166.635 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -69.51 105.99 1.54 Allowed 'Trans proline' 0 N--CA 1.457 -0.653 0 N-CA-C 104.233 -3.026 . . . . 0.0 104.233 165.754 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 63.0 pttt -39.27 -34.25 0.18 Allowed 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 118.772 2.878 . . . . 0.0 118.772 -163.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -55.3 -18.75 14.78 Favored Glycine 0 CA--C 1.541 1.684 0 CA-C-N 120.346 1.43 . . . . 0.0 114.202 172.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 4.2 tpm_? -57.82 -15.73 9.26 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 128.069 2.547 . . . . 0.0 112.598 169.056 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.1 t -148.49 137.52 21.72 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-O 122.816 1.293 . . . . 0.0 111.587 177.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 15.9 t -68.08 -53.25 31.0 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 CA-C-N 113.867 -1.515 . . . . 0.0 108.664 177.369 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.6 m -60.57 -42.29 91.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 CA-C-O 118.768 -0.634 . . . . 0.0 110.217 -177.501 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 13.0 t -64.61 -36.36 83.99 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.953 1.701 . . . . 0.0 110.274 177.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.9 m -66.04 -27.18 67.91 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 119.081 -0.485 . . . . 0.0 110.686 172.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.69 -36.18 67.04 Favored Glycine 0 C--N 1.343 0.968 0 CA-C-O 123.072 1.373 . . . . 0.0 111.457 168.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -73.51 -42.5 61.72 Favored 'General case' 0 N--CA 1.422 -1.869 0 N-CA-C 116.438 2.014 . . . . 0.0 116.438 -164.783 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -65.01 -21.62 66.87 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-O 118.472 -0.775 . . . . 0.0 110.359 174.82 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -80.7 -41.62 23.36 Favored 'General case' 0 C--N 1.35 0.602 0 CA-C-N 119.416 1.007 . . . . 0.0 110.161 166.516 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -58.67 -35.82 73.19 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.556 0.742 . . . . 0.0 111.182 179.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -58.67 -41.71 86.75 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.497 1.119 . . . . 0.0 110.424 176.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -63.26 -42.15 99.11 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 123.027 0.531 . . . . 0.0 109.896 175.324 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 50.7 tt0 -57.13 -52.6 64.65 Favored 'General case' 0 C--N 1.341 0.218 0 CA-C-N 118.075 0.398 . . . . 0.0 110.382 172.476 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -64.02 -39.59 94.44 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 121.513 -0.742 . . . . 0.0 110.94 -173.2 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.7 pp -75.5 -31.42 60.18 Favored 'General case' 0 C--N 1.342 0.264 0 CA-C-O 118.414 -0.803 . . . . 0.0 110.952 -177.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -72.76 -34.83 67.26 Favored 'General case' 0 C--N 1.343 0.325 0 CA-C-N 119.187 0.903 . . . . 0.0 110.738 172.657 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 13.5 mtm180 -67.8 -23.49 65.21 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 118.263 0.483 . . . . 0.0 111.269 169.359 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.4 tppt? 57.27 36.91 27.9 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 127.484 2.314 . . . . 0.0 111.258 -171.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 68.8 p -67.35 164.49 18.43 Favored 'General case' 0 CA--C 1.539 0.524 0 O-C-N 121.85 -0.531 . . . . 0.0 109.682 169.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.25 47.65 0.12 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.2 1.8 . . . . 0.0 114.442 -170.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 4.4 m -68.8 75.91 0.3 Allowed 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 126.444 1.898 . . . . 0.0 111.141 176.035 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 23.3 pttp . . . . . 0 CA--C 1.535 0.384 0 C-N-CA 125.222 1.409 . . . . 0.0 109.994 171.677 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.9 mtm . . . . . 0 CA--C 1.54 0.58 0 CA-C-O 119.643 -0.218 . . . . 0.0 110.589 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -84.95 58.18 5.12 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 123.078 2.519 . . . . 0.0 111.935 -168.89 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 21.1 mp0 -62.14 -24.73 67.33 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.311 -0.868 . . . . 0.0 111.463 169.665 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 38.0 tptt -147.45 -174.04 4.42 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 127.833 2.453 . . . . 0.0 105.564 168.7 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -131.04 90.54 38.92 Favored Pre-proline 0 N--CA 1.449 -0.493 0 N-CA-C 108.65 -0.871 . . . . 0.0 108.65 170.808 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -58.51 -31.03 93.47 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 123.988 3.125 . . . . 0.0 112.865 -174.465 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 56.2 m -93.75 -10.27 34.81 Favored 'General case' 0 N--CA 1.438 -1.041 0 C-N-CA 125.06 1.344 . . . . 0.0 112.523 -171.91 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.6 tp60 -62.74 -26.58 68.77 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 118.821 0.737 . . . . 0.0 110.623 178.344 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -56.48 -54.09 49.84 Favored 'General case' 0 C--O 1.226 -0.168 0 C-N-CA 123.745 0.818 . . . . 0.0 109.942 169.364 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -63.94 -46.79 83.15 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 118.47 -0.776 . . . . 0.0 109.604 -178.202 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -51.06 -40.05 57.42 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.772 1.229 . . . . 0.0 112.969 171.3 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 61.2 m -62.2 -43.0 99.81 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 119.407 -0.33 . . . . 0.0 110.642 172.2 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -64.73 -29.97 70.96 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 117.346 -1.311 . . . . 0.0 112.981 177.339 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.9 mp -57.39 -50.58 76.49 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 CA-C-N 121.021 1.737 . . . . 0.0 109.166 169.26 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 34.2 mm-40 -59.53 -54.59 44.79 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 178.584 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 53.6 mmtt -68.42 -30.8 69.78 Favored 'General case' 0 C--O 1.227 -0.116 0 C-N-CA 118.697 -1.201 . . . . 0.0 111.418 -172.807 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 19.9 t -56.21 -48.94 75.44 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 168.488 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.68 -47.35 82.58 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 118.866 -0.588 . . . . 0.0 110.523 178.808 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -56.74 -46.49 81.33 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.528 0.731 . . . . 0.0 111.199 174.618 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.71 -13.71 59.82 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.113 0.965 . . . . 0.0 113.518 175.759 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.6 m-80 -122.05 8.18 9.82 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 124.772 1.229 . . . . 0.0 111.946 -173.385 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 58.08 40.42 25.25 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 119.566 1.076 . . . . 0.0 110.853 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.261 7.0 m-85 72.29 14.27 5.51 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 127.816 2.447 . . . . 0.0 114.457 168.876 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 68.4 mtm -70.4 82.42 0.56 Allowed 'General case' 0 N--CA 1.441 -0.882 0 C-N-CA 125.212 1.405 . . . . 0.0 109.793 169.836 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -53.19 -24.14 10.17 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.366 1.066 . . . . 0.0 111.668 171.684 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.6 m -52.11 -40.08 60.76 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 126.517 1.927 . . . . 0.0 112.409 170.113 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 45.7 mmtt -72.16 -48.62 42.07 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 124.481 1.113 . . . . 0.0 108.706 174.813 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 78.9 m -73.59 1.38 10.21 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.299 1.44 . . . . 0.0 113.614 -173.763 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 53.4 mm-40 -52.65 -34.13 50.1 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 119.681 1.128 . . . . 0.0 111.222 169.123 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.23 -54.86 42.02 Favored 'General case' 0 C--N 1.343 0.291 0 C-N-CA 125.02 1.328 . . . . 0.0 111.387 175.011 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.0 p -75.59 -31.19 22.81 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.831 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.236 -173.034 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 75.2 mt -58.98 -45.9 91.87 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 N-CA-C 106.656 -1.609 . . . . 0.0 106.656 168.489 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.37 -27.57 62.42 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 120.969 -1.082 . . . . 0.0 113.052 173.662 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -76.47 -29.78 57.03 Favored 'General case' 0 N--CA 1.437 -1.097 0 C-N-CA 119.571 -0.851 . . . . 0.0 110.86 175.656 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.6 mt -64.45 -29.71 70.76 Favored 'General case' 0 C--N 1.343 0.311 0 CA-C-N 119.688 1.131 . . . . 0.0 109.213 168.648 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 16.7 mmt85 -66.03 -55.81 14.77 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 119.805 1.184 . . . . 0.0 108.719 -178.808 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.9 pttp -66.25 -27.11 67.71 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.157 -178.83 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 42.7 t -65.43 -54.83 22.93 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 168.397 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.1 t -62.55 -46.38 88.63 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 124.127 0.971 . . . . 0.0 112.137 -169.191 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.418 ' HA ' ' HE3' ' A' ' 44' ' ' LYS . . . -67.55 -4.02 10.44 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.003 -0.999 . . . . 0.0 112.879 -178.241 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -86.2 -6.2 59.04 Favored 'General case' 0 N--CA 1.439 -1.014 0 C-N-CA 124.851 1.26 . . . . 0.0 111.697 -178.753 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 72.3 m-85 -136.0 159.76 69.87 Favored Pre-proline 0 N--CA 1.446 -0.642 0 C-N-CA 124.434 1.094 . . . . 0.0 111.387 -168.949 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -67.76 109.24 1.84 Allowed 'Trans proline' 0 N--CA 1.455 -0.764 0 N-CA-C 104.778 -2.816 . . . . 0.0 104.778 165.389 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.418 ' HE3' ' HA ' ' A' ' 40' ' ' ALA . 38.5 mmtm -39.78 -38.43 0.65 Allowed 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 117.164 2.283 . . . . 0.0 117.164 -165.372 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.58 -17.23 25.86 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 123.854 0.74 . . . . 0.0 113.936 175.718 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 2.0 ttm180 -66.77 -8.08 25.83 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 126.946 2.098 . . . . 0.0 112.653 172.266 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 5.8 t -147.34 136.21 22.14 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 122.912 1.339 . . . . 0.0 112.076 174.415 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 19.9 t -71.73 -50.78 36.54 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.74 0 CA-C-N 113.615 -1.63 . . . . 0.0 108.762 176.717 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.4 m -60.34 -43.68 94.25 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.335 0 CA-C-O 118.402 -0.809 . . . . 0.0 109.835 179.722 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 25.5 t -63.22 -34.57 77.94 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.011 1.724 . . . . 0.0 110.451 178.131 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 48.7 m -65.73 -28.93 69.41 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 122.998 0.519 . . . . 0.0 110.875 171.588 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -67.68 -40.71 90.19 Favored Glycine 0 C--N 1.344 0.995 0 CA-C-O 124.167 1.982 . . . . 0.0 110.952 167.432 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -73.94 -40.29 63.18 Favored 'General case' 0 N--CA 1.417 -2.122 0 CA-C-N 111.786 -2.207 . . . . 0.0 116.128 -164.581 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -65.56 -29.35 69.95 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 118.324 -0.846 . . . . 0.0 110.638 170.929 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 50.4 tptt -70.79 -37.11 73.28 Favored 'General case' 0 C--N 1.347 0.496 0 CA-C-N 119.716 1.143 . . . . 0.0 110.662 169.883 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -57.46 -43.24 83.85 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.011 0.525 . . . . 0.0 110.21 169.955 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -65.08 -38.81 91.96 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.828 1.251 . . . . 0.0 110.276 179.972 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -60.93 -32.98 72.46 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 118.723 0.692 . . . . 0.0 111.831 173.398 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.0 tp10 -71.32 -45.89 61.93 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.512 0.596 . . . . 0.0 110.107 169.267 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -66.33 -36.67 83.51 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 117.736 -1.126 . . . . 0.0 112.606 -171.599 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 4.1 pp -59.49 -14.73 13.8 Favored 'General case' 0 C--N 1.343 0.308 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -179.239 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 2.9 t -104.23 -53.99 2.62 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 124.541 1.136 . . . . 0.0 108.819 167.183 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.7 tmm_? -53.17 -41.18 64.93 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.721 1.208 . . . . 0.0 112.616 -169.966 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.06 26.02 6.15 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 124.192 0.997 . . . . 0.0 112.644 173.797 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.477 ' C ' ' H ' ' A' ' 67' ' ' SER . 56.4 p 63.27 176.7 0.16 Allowed 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 127.13 2.172 . . . . 0.0 111.966 -169.805 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.41 12.86 0.08 Allowed 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.965 1.468 . . . . 0.0 114.965 176.716 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.477 ' H ' ' C ' ' A' ' 65' ' ' SER . 26.6 m -72.53 39.15 0.08 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 129.502 3.121 . . . . 0.0 112.093 177.383 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 2.5 pptp? . . . . . 0 N--CA 1.453 -0.312 0 C-N-CA 124.42 1.088 . . . . 0.0 110.918 178.679 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.5 mtt . . . . . 0 N--CA 1.449 -0.502 0 CA-C-O 118.228 -0.891 . . . . 0.0 109.003 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -67.16 -5.17 13.05 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.84 2.36 . . . . 0.0 116.499 -172.582 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 13.7 mp0 -64.05 -26.44 68.56 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 126.751 2.021 . . . . 0.0 110.023 167.655 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -124.28 86.97 2.65 Favored 'General case' 0 N--CA 1.444 -0.733 0 C-N-CA 126.912 2.085 . . . . 0.0 106.138 169.667 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.8 t0 -90.62 109.04 31.47 Favored Pre-proline 0 CA--C 1.539 0.553 0 N-CA-C 106.245 -1.761 . . . . 0.0 106.245 -174.824 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -68.67 -17.79 42.63 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 125.097 3.865 . . . . 0.0 113.672 -169.532 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 98.6 m -105.32 -9.3 17.7 Favored 'General case' 0 N--CA 1.435 -1.224 0 C-N-CA 127.056 2.143 . . . . 0.0 111.835 -170.451 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 16.9 tp60 -67.41 -22.48 65.53 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.704 -171.467 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -70.36 -46.79 63.41 Favored 'General case' 0 C--O 1.225 -0.232 0 O-C-N 121.449 -0.782 . . . . 0.0 110.057 173.687 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 19.0 mp0 -65.27 -40.57 94.1 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 127.255 2.222 . . . . 0.0 108.237 -172.583 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -52.16 -43.26 63.99 Favored 'General case' 0 C--N 1.34 0.166 0 C-N-CA 126.166 1.787 . . . . 0.0 112.707 169.232 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 84.0 m -60.99 -45.13 96.06 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.925 0.393 . . . . 0.0 110.299 175.709 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -63.83 -22.54 66.96 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 117.711 -1.137 . . . . 0.0 112.541 179.278 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 31.6 mm -59.17 -54.72 30.36 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.216 0 CA-C-N 120.408 1.458 . . . . 0.0 109.17 171.271 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -61.52 -51.79 67.15 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 -177.739 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 16.6 mtpp -67.9 -30.72 70.14 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 118.245 -0.884 . . . . 0.0 111.568 -174.725 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 15.6 t -58.51 -47.87 82.71 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-N 119.41 1.004 . . . . 0.0 108.512 168.787 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.72 -47.15 83.24 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 123.339 0.655 . . . . 0.0 110.392 178.997 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -58.45 -42.23 86.9 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.983 0.913 . . . . 0.0 111.681 174.195 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.63 -10.68 57.58 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 174.374 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -128.33 9.02 6.07 Favored 'General case' 0 C--N 1.344 0.362 0 CA-C-N 119.421 1.009 . . . . 0.0 112.59 -171.852 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 16.2 m 61.03 38.87 16.96 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 119.496 1.044 . . . . 0.0 110.39 177.777 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.265 7.1 m-85 72.2 14.81 5.52 Favored 'General case' 0 N--CA 1.444 -0.735 0 C-N-CA 127.656 2.382 . . . . 0.0 114.431 168.788 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 58.7 mtm -70.9 85.94 0.69 Allowed 'General case' 0 N--CA 1.441 -0.9 0 C-N-CA 124.84 1.256 . . . . 0.0 109.881 170.616 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -52.56 -24.85 9.0 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.265 1.026 . . . . 0.0 111.149 169.556 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.4 m -53.77 -38.83 64.86 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 127.511 2.324 . . . . 0.0 113.013 170.409 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 9.9 mmpt? -75.74 -47.6 25.33 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 173.45 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.6 m -71.89 2.64 5.22 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.626 1.17 . . . . 0.0 113.401 -174.568 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -52.98 -30.96 38.16 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 119.439 1.018 . . . . 0.0 110.695 167.763 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.65 -59.58 5.21 Favored 'General case' 0 C--N 1.346 0.444 0 C-N-CA 125.616 1.566 . . . . 0.0 111.68 173.7 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.5 p -71.29 -29.5 36.14 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.716 0 C-N-CA 123.761 0.825 . . . . 0.0 110.08 -174.27 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 71.7 mt -59.91 -49.85 82.34 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 N-CA-C 106.543 -1.651 . . . . 0.0 106.543 169.239 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.4 ' HA ' ' CG ' ' A' ' 36' ' ' ARG . 1.0 OUTLIER -56.86 -25.3 56.19 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 119.451 1.023 . . . . 0.0 112.909 175.482 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -74.84 -41.55 59.66 Favored 'General case' 0 N--CA 1.44 -0.953 0 CA-C-N 118.925 0.784 . . . . 0.0 110.819 173.802 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.4 mt -62.92 -31.31 72.35 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-O 117.797 -1.097 . . . . 0.0 110.208 170.447 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.4 ' CG ' ' HA ' ' A' ' 33' ' ' GLN . 25.9 mmt85 -63.37 -56.4 16.64 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 120.067 1.303 . . . . 0.0 108.443 179.076 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.8 pttt -67.65 -28.4 67.68 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.951 -174.517 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 47.8 t -66.55 -54.51 22.86 Favored 'General case' 0 N--CA 1.44 -0.925 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 168.246 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.8 t -59.48 -50.06 75.4 Favored 'General case' 0 CA--C 1.512 -0.512 0 C-N-CA 124.332 1.053 . . . . 0.0 111.842 -169.573 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.11 -1.53 6.15 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.025 -0.989 . . . . 0.0 112.414 -174.608 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.468 ' HB3' ' CE2' ' A' ' 42' ' ' TYR . 2.0 tp-100 -81.9 -10.28 59.34 Favored 'General case' 0 N--CA 1.436 -1.158 0 C-N-CA 124.344 1.058 . . . . 0.0 111.578 174.76 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.468 ' CE2' ' HB3' ' A' ' 41' ' ' GLN . 68.7 m-85 -138.71 158.91 69.32 Favored Pre-proline 0 N--CA 1.445 -0.712 0 C-N-CA 124.187 0.995 . . . . 0.0 112.014 -167.666 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -72.1 147.62 48.92 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 121.735 1.623 . . . . 0.0 108.373 167.622 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -51.94 -42.93 63.23 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 -173.669 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.96 -14.24 23.11 Favored Glycine 0 CA--C 1.53 0.974 0 CA-C-O 119.032 -0.871 . . . . 0.0 113.257 -178.858 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.54 -17.08 56.71 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 118.894 1.347 . . . . 0.0 113.095 176.052 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 9.6 t -151.95 128.51 10.74 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-O 123.537 1.636 . . . . 0.0 112.901 -175.234 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 12.0 t -68.5 -50.85 52.56 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 CA-C-N 112.679 -2.055 . . . . 0.0 108.698 178.942 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 16.0 m -61.84 -43.53 97.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 CA-C-O 118.46 -0.781 . . . . 0.0 110.083 -178.578 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 18.5 t -63.86 -34.58 78.26 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.582 1.553 . . . . 0.0 110.227 177.886 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.0 m -65.07 -29.64 70.54 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 122.788 0.435 . . . . 0.0 110.675 171.99 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.1 -37.54 82.44 Favored Glycine 0 C--N 1.344 1.002 0 CA-C-O 123.089 1.383 . . . . 0.0 111.104 167.987 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -75.08 -40.25 60.25 Favored 'General case' 0 N--CA 1.417 -2.075 0 N-CA-C 117.097 2.258 . . . . 0.0 117.097 -163.74 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -62.33 -21.31 65.18 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.674 171.853 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 35.0 mtmm -81.2 -45.63 16.05 Favored 'General case' 0 C--N 1.348 0.543 0 CA-C-N 119.563 1.074 . . . . 0.0 110.425 167.016 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -58.71 -29.66 66.84 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.95 1.3 . . . . 0.0 112.132 -179.37 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -58.46 -53.73 54.99 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 126.458 1.903 . . . . 0.0 108.979 174.867 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -62.29 -41.66 98.69 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.316 0.646 . . . . 0.0 110.281 175.308 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -56.78 -37.71 71.49 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 124.114 0.965 . . . . 0.0 111.817 178.879 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -80.14 -49.28 11.91 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 118.305 -0.855 . . . . 0.0 110.917 174.57 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 47.2 mt -55.82 -41.06 73.65 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 118.823 0.738 . . . . 0.0 111.505 -174.899 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -70.17 -41.15 74.17 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 122.181 0.192 . . . . 0.0 111.441 179.439 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 13.6 mtp-105 -83.16 -34.87 25.91 Favored 'General case' 0 N--CA 1.461 0.117 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 -173.371 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 24.7 mtpp -123.07 16.98 10.01 Favored 'General case' 0 C--O 1.23 0.056 0 C-N-CA 125.512 1.525 . . . . 0.0 113.99 -165.302 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 8.4 t 61.06 -164.55 0.24 Allowed 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.499 1.52 . . . . 0.0 111.341 -173.461 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -64.61 54.52 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 128.552 2.741 . . . . 0.0 115.719 -168.988 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 51.0 m -67.66 41.16 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 127.15 2.18 . . . . 0.0 113.938 171.41 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 63.9 tttm . . . . . 0 N--CA 1.456 -0.133 0 C-N-CA 125.018 1.327 . . . . 0.0 109.461 175.715 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.3 mtt . . . . . 0 CA--C 1.536 0.441 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -68.31 108.33 1.76 Allowed 'Trans proline' 0 N--CA 1.458 -0.583 0 C-N-CA 123.188 2.592 . . . . 0.0 109.608 176.575 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.417 ' H ' ' NE2' ' A' ' 3' ' ' GLN . 2.8 mp0 -64.58 -36.18 83.39 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 122.09 -0.381 . . . . 0.0 110.956 -176.107 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -74.37 33.07 0.09 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 127.307 2.243 . . . . 0.0 112.872 -178.819 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.0 t0 -128.36 97.48 28.28 Favored Pre-proline 0 N--CA 1.446 -0.669 0 C-N-CA 126.761 2.024 . . . . 0.0 108.935 -173.973 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -55.25 -34.58 88.75 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 124.091 3.194 . . . . 0.0 112.77 -173.695 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 85.7 m -94.9 -13.09 25.76 Favored 'General case' 0 N--CA 1.436 -1.168 0 C-N-CA 125.403 1.481 . . . . 0.0 113.581 -168.305 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.1 tp60 -61.29 -26.57 67.87 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 122.99 0.516 . . . . 0.0 110.803 -179.968 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.2 ttpp -62.29 -54.31 42.57 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.521 0.728 . . . . 0.0 110.377 169.971 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 27.1 mm-40 -59.12 -44.83 92.04 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.405 0.682 . . . . 0.0 110.107 -177.293 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -51.26 -42.58 61.17 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 125.728 1.611 . . . . 0.0 112.626 170.846 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.401 ' HB3' ' HE2' ' A' ' 16' ' ' LYS . 93.8 m -61.66 -46.27 90.45 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 117.854 0.297 . . . . 0.0 110.931 173.004 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -62.59 -22.22 66.21 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 117.662 -1.161 . . . . 0.0 112.633 179.091 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 27.3 mm -57.78 -53.61 42.67 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.218 0 CA-C-N 120.397 1.453 . . . . 0.0 109.614 171.796 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 -58.64 -55.85 29.75 Favored 'General case' 0 N--CA 1.445 -0.678 0 O-C-N 124.19 0.932 . . . . 0.0 109.002 -179.316 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.401 ' HE2' ' HB3' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -66.65 -31.54 72.28 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 118.807 -1.157 . . . . 0.0 112.138 -175.004 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 24.1 t -55.67 -48.72 74.58 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 119.491 1.041 . . . . 0.0 108.758 169.18 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.44 -46.7 86.02 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-O 118.863 -0.589 . . . . 0.0 110.48 179.533 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -57.03 -46.33 82.47 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.419 0.688 . . . . 0.0 111.34 174.402 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.49 -13.03 57.95 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.262 1.025 . . . . 0.0 113.4 175.66 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -123.21 8.54 9.16 Favored 'General case' 0 C--N 1.342 0.26 0 C-N-CA 124.66 1.184 . . . . 0.0 111.959 -173.333 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.3 m 58.23 40.13 25.08 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 119.636 1.107 . . . . 0.0 110.863 179.415 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.26 7.0 m-85 72.19 13.98 5.65 Favored 'General case' 0 N--CA 1.443 -0.796 0 C-N-CA 127.957 2.503 . . . . 0.0 114.499 168.902 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 67.0 mtm -69.93 84.72 0.5 Allowed 'General case' 0 N--CA 1.44 -0.955 0 C-N-CA 125.204 1.402 . . . . 0.0 109.837 170.002 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -53.79 -25.07 17.48 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.502 0.721 . . . . 0.0 111.524 171.105 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.2 m -53.1 -38.64 62.77 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 126.413 1.885 . . . . 0.0 112.631 170.691 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.8 mmtm -72.95 -47.73 42.95 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.267 1.027 . . . . 0.0 108.671 173.454 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.3 m -73.74 3.24 6.76 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 124.797 1.239 . . . . 0.0 113.637 -173.074 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 64.2 mm-40 -54.82 -29.72 55.46 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.2 -0.937 . . . . 0.0 110.542 167.067 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.71 -55.39 35.75 Favored 'General case' 0 C--N 1.345 0.4 0 C-N-CA 125.567 1.547 . . . . 0.0 111.708 172.606 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.5 p -75.81 -29.37 20.14 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 C-N-CA 123.605 0.762 . . . . 0.0 110.16 -173.467 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 59.2 mt -61.04 -46.78 96.0 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 N-CA-C 106.058 -1.83 . . . . 0.0 106.058 168.213 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.81 -26.58 62.18 Favored 'General case' 0 N--CA 1.453 -0.304 0 O-C-N 120.853 -1.155 . . . . 0.0 113.436 172.884 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -76.39 -32.32 58.49 Favored 'General case' 0 N--CA 1.432 -1.33 0 C-N-CA 119.492 -0.883 . . . . 0.0 110.743 175.705 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.8 mt -64.02 -32.83 74.51 Favored 'General case' 0 C--O 1.22 -0.455 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 168.46 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.4 mmt85 -64.71 -57.23 9.55 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 119.913 1.233 . . . . 0.0 109.24 -179.119 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.9 pttp -64.95 -29.64 70.58 Favored 'General case' 0 C--O 1.233 0.186 0 O-C-N 123.543 0.527 . . . . 0.0 111.087 -176.082 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 51.1 t -65.27 -54.19 32.95 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 168.729 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 48.7 t -62.6 -47.07 85.39 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 121.514 -0.741 . . . . 0.0 111.838 -169.921 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.53 -0.89 7.34 Favored 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 124.484 1.114 . . . . 0.0 112.429 -176.728 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.408 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 1.8 tp-100 -77.28 -11.52 59.84 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-N 119.1 0.864 . . . . 0.0 111.572 171.667 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.408 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 54.1 m-85 -141.44 160.64 56.25 Favored Pre-proline 0 N--CA 1.438 -1.053 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -164.23 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -69.82 114.85 3.85 Favored 'Trans proline' 0 N--CA 1.455 -0.758 0 N-CA-C 105.283 -2.622 . . . . 0.0 105.283 165.069 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.43 -29.57 1.14 Allowed 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 117.586 2.439 . . . . 0.0 117.586 -166.577 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -54.1 -17.16 7.16 Favored Glycine 0 CA--C 1.538 1.509 0 CA-C-N 119.601 1.091 . . . . 0.0 114.075 171.852 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.4 ' HG2' ' CG ' ' A' ' 42' ' ' TYR . 8.3 tpm_? -52.16 -29.15 20.81 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 127.589 2.356 . . . . 0.0 112.386 168.017 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.4 t -149.25 139.82 22.55 Favored 'General case' 0 N--CA 1.439 -1.012 0 CA-C-O 122.804 1.288 . . . . 0.0 112.048 -168.277 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.1 t -67.79 -55.03 18.4 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.658 0 CA-C-N 113.747 -1.569 . . . . 0.0 108.704 176.655 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.3 m -61.19 -43.2 95.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 CA-C-O 118.382 -0.818 . . . . 0.0 109.954 -177.106 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 29.5 t -64.57 -32.07 73.56 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.4 1.48 . . . . 0.0 110.18 178.934 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 52.3 m -67.25 -26.93 66.82 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 119.075 -0.488 . . . . 0.0 110.893 171.742 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -71.0 -36.15 64.58 Favored Glycine 0 C--N 1.345 1.05 0 CA-C-O 123.798 1.776 . . . . 0.0 111.092 167.288 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -78.47 -40.3 35.91 Favored 'General case' 0 N--CA 1.412 -2.339 0 N-CA-C 116.293 1.96 . . . . 0.0 116.293 -163.846 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -63.14 -29.25 70.65 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 119.483 -0.887 . . . . 0.0 110.342 170.858 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 19.4 tptp -69.02 -44.7 72.19 Favored 'General case' 0 C--N 1.349 0.564 0 CA-C-N 119.383 0.992 . . . . 0.0 110.408 170.513 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -55.05 -51.05 67.55 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.512 1.125 . . . . 0.0 109.6 176.123 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 72.1 tt0 -62.14 -35.89 80.14 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 126.255 1.822 . . . . 0.0 110.934 -178.249 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -61.28 -36.56 80.4 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.168 0.587 . . . . 0.0 111.286 173.834 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -63.44 -45.33 91.36 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-N 118.965 0.802 . . . . 0.0 109.674 171.099 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -68.71 -24.58 64.49 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 117.655 -1.164 . . . . 0.0 112.3 -171.791 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 49.0 mt -50.8 -22.29 2.08 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.204 1.002 . . . . 0.0 113.004 172.524 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 38.6 p -57.13 -70.1 0.14 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.28 1.032 . . . . 0.0 109.861 168.972 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -55.02 -50.91 67.86 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 126.391 1.877 . . . . 0.0 110.579 175.392 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.3 ttpm? -75.74 39.77 0.18 Allowed 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 128.085 2.554 . . . . 0.0 110.839 178.847 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.1 m -66.23 156.9 32.88 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 123.786 0.834 . . . . 0.0 110.076 171.606 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -157.5 -178.14 7.12 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 126.121 1.768 . . . . 0.0 107.798 176.777 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 71.9 p -70.85 65.1 0.33 Allowed 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.912 1.285 . . . . 0.0 109.925 169.589 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 90.6 mttt . . . . . 0 C--O 1.232 0.132 0 C-N-CA 125.318 1.447 . . . . 0.0 109.527 -176.111 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.546 0.803 0 CA-C-O 119.261 -0.4 . . . . 0.0 111.105 . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -50.51 123.64 11.72 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 123.151 2.567 . . . . 0.0 110.866 170.433 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 67.8 mm-40 -75.94 45.91 0.36 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.675 1.59 . . . . 0.0 112.808 -169.891 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -68.43 158.7 33.11 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 167.635 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 47.3 t0 -93.3 102.01 6.65 Favored Pre-proline 0 CA--C 1.54 0.584 0 C-N-CA 123.217 0.607 . . . . 0.0 109.589 -173.132 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.54 -25.55 29.5 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 123.629 2.886 . . . . 0.0 112.4 -176.14 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 66.0 m -92.66 -11.51 33.93 Favored 'General case' 0 N--CA 1.435 -1.192 0 C-N-CA 124.518 1.127 . . . . 0.0 110.89 -170.699 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 21.4 tp60 -64.34 -25.0 67.84 Favored 'General case' 0 N--CA 1.442 -0.83 0 C-N-CA 123.36 0.664 . . . . 0.0 110.686 179.599 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -62.14 -53.83 49.79 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 123.477 0.711 . . . . 0.0 110.02 169.115 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -62.97 -38.89 92.9 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.043 0.537 . . . . 0.0 109.675 -176.662 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.32 -44.38 72.0 Favored 'General case' 0 C--N 1.342 0.272 0 C-N-CA 125.327 1.451 . . . . 0.0 112.222 169.784 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 85.3 m -58.54 -45.82 88.12 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 117.734 0.243 . . . . 0.0 110.531 173.573 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.0 mm-40 -67.3 -16.63 64.38 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 117.495 -1.24 . . . . 0.0 112.681 -179.864 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 42.2 mm -59.85 -54.3 36.59 Favored 'Isoleucine or valine' 0 C--N 1.34 0.17 0 CA-C-N 121.09 1.768 . . . . 0.0 107.847 169.118 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 50.9 mm-40 -57.27 -52.77 63.98 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.249 -0.887 . . . . 0.0 109.202 174.291 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 18.5 mmmt -65.34 -32.32 73.9 Favored 'General case' 0 C--N 1.334 -0.073 0 C-N-CA 118.741 -1.184 . . . . 0.0 111.757 -172.913 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 17.5 t -57.69 -51.45 69.47 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 169.72 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.65 -47.77 73.13 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.968 0.907 . . . . 0.0 110.876 178.229 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.453 ' HA ' ' CE1' ' A' ' 23' ' ' TYR . 0.6 OUTLIER -55.9 -45.36 78.68 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.024 0.93 . . . . 0.0 111.473 174.07 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.88 -10.99 60.57 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 114.381 1.252 . . . . 0.0 114.381 176.577 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -126.37 16.51 7.7 Favored 'General case' 0 C--N 1.343 0.321 0 CA-C-N 119.806 1.185 . . . . 0.0 113.749 -168.401 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 17.6 m 60.17 34.68 21.1 Favored 'General case' 0 C--N 1.345 0.401 0 CA-C-N 120.523 1.511 . . . . 0.0 110.285 -179.192 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.453 ' CE1' ' HA ' ' A' ' 19' ' ' GLN . 46.4 m-85 67.33 16.43 10.09 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 126.832 2.053 . . . . 0.0 113.719 168.406 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 65.2 mtm -73.7 90.98 1.86 Allowed 'General case' 0 N--CA 1.439 -0.987 0 C-N-CA 126.168 1.787 . . . . 0.0 109.114 175.368 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -54.68 -23.56 17.97 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.982 -0.449 . . . . 0.0 111.469 170.862 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.2 m -53.73 -41.32 66.94 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 126.588 1.955 . . . . 0.0 112.412 170.299 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 61.2 mmtt -71.29 -45.99 61.83 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 124.103 0.961 . . . . 0.0 108.891 173.581 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 86.3 m -73.97 3.47 6.79 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 124.336 1.054 . . . . 0.0 113.012 -172.88 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 79.8 mm-40 -56.45 -27.74 57.66 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.467 -0.771 . . . . 0.0 110.541 166.234 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.31 -60.46 3.78 Favored 'General case' 0 C--N 1.345 0.39 0 C-N-CA 125.403 1.481 . . . . 0.0 111.423 172.003 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.1 p -71.62 -25.92 25.35 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 C-N-CA 123.835 0.854 . . . . 0.0 110.004 -175.093 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 17.0 mt -60.02 -52.46 60.9 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 N-CA-C 106.684 -1.599 . . . . 0.0 106.684 168.101 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.446 ' HA ' ' CG ' ' A' ' 36' ' ' ARG . 8.6 tt0 -55.25 -36.65 66.29 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-O 118.792 -0.623 . . . . 0.0 110.305 178.588 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -65.25 -41.99 93.74 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 118.685 0.675 . . . . 0.0 111.703 176.065 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.451 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 0.7 OUTLIER -61.44 -38.59 87.72 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-O 117.005 -1.474 . . . . 0.0 110.418 173.236 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.572 HH21 ' NH2' ' A' ' 63' ' ' ARG 0.275 9.3 ptt85 -70.08 -39.76 75.4 Favored 'General case' 0 C--N 1.341 0.226 0 CA-C-N 120.66 1.573 . . . . 0.0 110.605 -179.865 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.8 mmtp -64.14 -37.1 86.22 Favored 'General case' 0 C--N 1.344 0.34 0 CA-C-N 118.716 0.689 . . . . 0.0 111.188 175.859 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 49.3 t -60.66 -53.18 60.5 Favored 'General case' 0 C--O 1.22 -0.448 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 170.528 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.3 t -57.56 -44.97 85.64 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 125.306 1.443 . . . . 0.0 113.142 -169.646 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.401 ' HA ' ' HE3' ' A' ' 44' ' ' LYS . . . -76.33 -1.11 25.15 Favored 'General case' 0 N--CA 1.441 -0.902 0 O-C-N 124.67 1.231 . . . . 0.0 112.631 -176.268 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.431 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 3.5 tp-100 -91.86 -1.85 57.13 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 124.23 1.012 . . . . 0.0 112.754 -168.827 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.481 ' HB2' ' CZ ' ' A' ' 46' ' ' ARG . 84.7 m-85 -142.56 165.97 23.66 Favored Pre-proline 0 N--CA 1.443 -0.781 0 C-N-CA 125.985 1.714 . . . . 0.0 110.641 -167.474 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -61.93 139.93 82.21 Favored 'Trans proline' 0 CA--C 1.538 0.68 0 C-N-CA 121.798 1.665 . . . . 0.0 109.433 169.164 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.401 ' HE3' ' HA ' ' A' ' 40' ' ' ALA . 41.1 mmtm -71.44 -5.51 33.43 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 114.699 1.37 . . . . 0.0 114.699 -169.186 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -86.86 -12.79 68.01 Favored Glycine 0 CA--C 1.533 1.179 0 CA-C-O 118.636 -1.091 . . . . 0.0 113.669 169.933 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.481 ' CZ ' ' HB2' ' A' ' 42' ' ' TYR . 0.0 OUTLIER -74.39 -9.85 59.0 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.768 1.784 . . . . 0.0 112.757 -173.596 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 16.0 t -145.4 146.26 31.48 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 120.909 -1.119 . . . . 0.0 112.053 -174.656 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 23.6 t -84.26 -55.11 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 C-N-CA 126.177 1.791 . . . . 0.0 108.826 173.103 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.8 m -58.22 -41.35 80.75 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 118.212 0.46 . . . . 0.0 110.745 -173.724 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 9.2 t -64.22 -34.48 78.19 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.281 1.433 . . . . 0.0 109.871 -179.928 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.1 p -64.94 -27.16 68.65 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 121.995 -0.44 . . . . 0.0 111.016 174.065 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.09 -45.12 58.01 Favored Glycine 0 C--N 1.348 1.196 0 CA-C-O 123.902 1.834 . . . . 0.0 110.172 168.391 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.451 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.6 OUTLIER -63.73 -39.74 95.04 Favored 'General case' 0 N--CA 1.415 -2.19 0 CA-C-N 111.937 -2.131 . . . . 0.0 115.354 -167.276 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -64.08 -22.53 66.97 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 118.649 -0.691 . . . . 0.0 111.079 178.747 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm -73.46 -38.88 65.31 Favored 'General case' 0 C--N 1.345 0.398 0 CA-C-N 119.186 0.903 . . . . 0.0 110.736 168.743 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -66.69 -28.53 68.52 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.808 -0.557 . . . . 0.0 111.826 171.972 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -64.6 -34.48 78.36 Favored 'General case' 0 C--O 1.227 -0.127 0 O-C-N 121.229 -0.919 . . . . 0.0 110.675 177.384 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -59.38 -39.56 83.73 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 118.411 0.55 . . . . 0.0 110.607 171.353 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -66.39 -47.4 73.43 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 122.538 0.335 . . . . 0.0 111.561 171.445 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -70.21 -22.85 62.88 Favored 'General case' 0 CA--C 1.522 -0.121 0 C-N-CA 124.113 0.965 . . . . 0.0 112.588 -173.63 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 15.2 mt -57.42 -11.53 1.97 Allowed 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 124.257 1.023 . . . . 0.0 113.211 172.883 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 27.2 p -62.95 -62.4 1.74 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.211 1.005 . . . . 0.0 108.862 166.496 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.572 ' NH2' HH21 ' A' ' 36' ' ' ARG . 11.8 ttp180 -60.74 -45.45 94.24 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 127.268 2.227 . . . . 0.0 111.96 174.547 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 22.7 pttp 42.73 15.36 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 131.323 3.849 . . . . 0.0 118.354 -175.598 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.435 ' C ' ' H ' ' A' ' 67' ' ' SER . 3.4 t 54.64 -167.0 0.09 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.064 1.346 . . . . 0.0 111.117 -169.07 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.56 22.75 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.038 1.735 . . . . 0.0 115.021 -176.947 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.435 ' H ' ' C ' ' A' ' 65' ' ' SER . 13.1 m -71.29 32.24 0.05 OUTLIER 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 129.31 3.044 . . . . 0.0 113.328 -175.829 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 13.0 mptt . . . . . 0 N--CA 1.446 -0.66 0 C-N-CA 125.983 1.713 . . . . 0.0 108.913 -175.633 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.7 mtp . . . . . 0 CA--C 1.537 0.452 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -75.42 61.2 5.94 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.605 2.87 . . . . 0.0 110.997 176.614 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -68.59 156.38 38.2 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.449 1.1 . . . . 0.0 110.471 177.625 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -74.36 55.35 0.61 Allowed 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.74 1.616 . . . . 0.0 110.551 170.994 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -128.12 105.64 20.01 Favored Pre-proline 0 N--CA 1.441 -0.883 0 C-N-CA 129.363 3.065 . . . . 0.0 108.343 -167.46 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -60.47 -16.63 43.21 Favored 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 124.31 3.34 . . . . 0.0 114.948 -173.65 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 64.2 m -108.57 -6.97 15.82 Favored 'General case' 0 N--CA 1.441 -0.92 0 C-N-CA 127.027 2.131 . . . . 0.0 112.272 -170.465 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 8.0 tp60 -67.89 -22.79 65.07 Favored 'General case' 0 N--CA 1.447 -0.597 0 O-C-N 121.615 -0.678 . . . . 0.0 112.278 -173.018 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 47.5 tptt -67.26 -49.56 63.93 Favored 'General case' 0 C--O 1.226 -0.143 0 CA-C-O 122.028 0.918 . . . . 0.0 109.446 173.456 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 20.4 mp0 -61.64 -43.13 99.44 Favored 'General case' 0 N--CA 1.442 -0.86 0 C-N-CA 127.641 2.377 . . . . 0.0 107.995 -173.962 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -53.78 -41.32 67.1 Favored 'General case' 0 C--N 1.341 0.213 0 C-N-CA 126.562 1.945 . . . . 0.0 114.016 169.797 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.0 m -63.27 -44.84 93.98 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 122.408 0.283 . . . . 0.0 110.263 173.716 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -64.83 -24.88 67.68 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 117.688 -1.148 . . . . 0.0 112.243 179.739 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 37.5 mm -56.54 -50.87 71.36 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.221 0 CA-C-N 120.273 1.397 . . . . 0.0 109.4 169.453 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 45.8 mm-40 -59.97 -56.28 23.68 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 106.971 -1.492 . . . . 0.0 106.971 -175.145 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 44.5 mttt -70.41 -30.19 67.0 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 118.182 -0.913 . . . . 0.0 111.233 -171.618 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 18.9 t -57.26 -47.06 82.37 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 169.185 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.26 -45.75 90.36 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 118.435 -0.793 . . . . 0.0 110.169 179.649 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -58.29 -45.68 87.5 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 119.328 0.967 . . . . 0.0 111.301 174.255 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.93 -13.94 58.53 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 175.862 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -123.86 9.25 8.8 Favored 'General case' 0 C--N 1.343 0.322 0 C-N-CA 124.302 1.041 . . . . 0.0 112.24 -172.928 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.4 m 58.03 40.45 25.39 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 122.404 1.097 . . . . 0.0 110.842 179.369 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.265 6.8 m-85 72.25 14.36 5.53 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 127.801 2.44 . . . . 0.0 114.428 168.79 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 63.0 mtm -69.45 86.27 0.44 Allowed 'General case' 0 N--CA 1.442 -0.843 0 C-N-CA 125.175 1.39 . . . . 0.0 110.329 170.122 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -54.36 -22.97 13.68 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.457 1.103 . . . . 0.0 111.323 169.486 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.6 m -58.02 -40.64 81.35 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 127.027 2.131 . . . . 0.0 112.631 170.085 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.7 mmtm -72.91 -47.73 43.2 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 124.138 0.975 . . . . 0.0 108.561 174.375 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.0 m -70.14 3.33 2.87 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.034 1.334 . . . . 0.0 113.424 -176.791 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.603 HE22 ' NH1' ' A' ' 63' ' ' ARG . 85.1 mm-40 -53.37 -31.7 45.86 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 119.304 0.956 . . . . 0.0 111.122 167.204 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.64 -50.16 74.93 Favored 'General case' 0 C--N 1.344 0.362 0 C-N-CA 125.028 1.331 . . . . 0.0 112.116 174.851 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.7 p -80.91 -29.96 11.66 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.809 0 C-N-CA 123.391 0.677 . . . . 0.0 109.845 -174.256 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 68.8 mt -63.25 -40.66 89.9 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 169.366 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.67 -34.71 59.61 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 123.727 0.811 . . . . 0.0 112.001 170.232 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -74.85 -42.8 57.25 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 119.806 -0.758 . . . . 0.0 110.846 179.504 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.4 mt -64.23 -30.9 71.94 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 118.276 -0.869 . . . . 0.0 110.311 174.425 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.22 -61.88 2.27 Favored 'General case' 0 CA--C 1.518 -0.269 0 C-N-CA 124.437 1.095 . . . . 0.0 108.756 175.661 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -64.58 -28.12 69.41 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 114.372 -1.286 . . . . 0.0 110.66 -173.499 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 49.4 t -66.28 -55.37 16.41 Favored 'General case' 0 N--CA 1.442 -0.83 0 C-N-CA 123.511 0.724 . . . . 0.0 109.258 168.273 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 47.8 t -60.0 -43.81 94.95 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 123.94 0.896 . . . . 0.0 112.516 -170.859 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.85 -4.32 15.85 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.845 -1.07 . . . . 0.0 113.006 -176.313 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.428 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 3.1 tp-100 -91.7 -4.82 54.67 Favored 'General case' 0 N--CA 1.437 -1.084 0 C-N-CA 125.355 1.462 . . . . 0.0 112.122 -172.6 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.428 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 78.9 m-85 -139.15 161.32 58.3 Favored Pre-proline 0 N--CA 1.446 -0.628 0 C-N-CA 124.132 0.973 . . . . 0.0 112.244 -168.133 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -69.48 98.99 0.69 Allowed 'Trans proline' 0 N--CA 1.456 -0.709 0 N-CA-C 105.096 -2.694 . . . . 0.0 105.096 165.384 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? -39.34 -30.69 0.07 Allowed 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 117.904 2.557 . . . . 0.0 117.904 -165.556 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -54.81 -18.44 11.28 Favored Glycine 0 CA--C 1.541 1.659 0 CA-C-N 120.219 1.372 . . . . 0.0 114.097 170.021 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.0 tpm_? -55.8 -24.04 33.63 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 127.95 2.5 . . . . 0.0 112.053 168.957 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.5 t -144.64 130.16 18.93 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-O 123.387 1.565 . . . . 0.0 112.497 -172.298 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.7 t -69.82 -49.8 54.35 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.758 0 CA-C-N 112.952 -1.931 . . . . 0.0 108.72 176.677 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.4 m -62.58 -42.04 94.38 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-O 118.512 -0.756 . . . . 0.0 110.352 -178.319 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.7 t -64.82 -35.28 80.6 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.757 1.623 . . . . 0.0 110.191 176.235 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.3 m -65.44 -28.9 69.56 Favored 'General case' 0 CA--C 1.535 0.398 0 O-C-N 122.082 -0.386 . . . . 0.0 110.525 171.727 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.56 -32.99 71.42 Favored Glycine 0 C--N 1.345 1.052 0 CA-C-O 122.801 1.223 . . . . 0.0 111.366 167.939 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -80.21 -42.08 23.98 Favored 'General case' 0 N--CA 1.422 -1.839 0 N-CA-C 116.103 1.89 . . . . 0.0 116.103 -165.211 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -63.28 -26.04 68.59 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 119.841 -0.744 . . . . 0.0 110.404 171.014 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.3 tpmt? -73.38 -40.25 64.49 Favored 'General case' 0 C--N 1.347 0.477 0 CA-C-N 118.962 0.801 . . . . 0.0 110.454 168.641 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -59.31 -40.35 85.97 Favored 'General case' 0 C--O 1.221 -0.419 0 CA-C-N 118.48 0.582 . . . . 0.0 110.408 173.023 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -63.51 -40.83 98.09 Favored 'General case' 0 C--N 1.332 -0.165 0 C-N-CA 125.036 1.334 . . . . 0.0 110.155 179.128 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -58.69 -43.74 90.07 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 118.134 0.425 . . . . 0.0 110.5 170.283 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -61.16 -39.79 91.43 Favored 'General case' 0 CA--C 1.535 0.403 0 O-C-N 121.86 -0.525 . . . . 0.0 111.985 173.061 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -64.15 -29.46 70.58 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 124.646 1.178 . . . . 0.0 111.154 -178.466 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 89.8 mt -55.01 -34.42 63.43 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 118.862 0.755 . . . . 0.0 111.296 170.067 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 24.2 p -84.5 -49.08 8.94 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 124.693 1.197 . . . . 0.0 111.082 177.522 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.603 ' NH1' HE22 ' A' ' 29' ' ' GLN . 8.9 ttp180 -70.42 -29.32 65.89 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.427 1.491 . . . . 0.0 112.343 -171.832 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 53.8 mttp 60.61 168.07 0.09 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 129.809 3.243 . . . . 0.0 114.847 173.543 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 85.1 p 168.9 -177.72 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 130.683 3.593 . . . . 0.0 106.293 -176.041 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.8 9.03 0.98 Allowed 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 114.524 1.305 . . . . 0.0 114.524 169.18 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 7.7 t -140.9 37.13 1.78 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 128.2 2.6 . . . . 0.0 109.297 170.994 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 33.7 mmtp . . . . . 0 C--N 1.344 0.351 0 C-N-CA 126.213 1.805 . . . . 0.0 111.128 -172.094 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.446 -0.675 0 CA-C-O 119.301 -0.381 . . . . 0.0 111.083 . . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -80.85 -175.15 2.53 Favored 'Trans proline' 0 CA--C 1.545 1.026 0 C-N-CA 123.559 2.839 . . . . 0.0 110.53 169.098 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 59.43 -58.55 0.06 Allowed 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 129.658 3.183 . . . . 0.0 117.276 169.378 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.9 mppt? -64.57 160.52 19.39 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.656 1.182 . . . . 0.0 110.267 -171.989 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.2 t0 -94.46 102.1 7.99 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 124.94 1.296 . . . . 0.0 108.237 177.574 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -61.52 -30.95 87.23 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 125.247 3.964 . . . . 0.0 113.056 -172.36 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 87.9 m -94.16 -15.55 24.53 Favored 'General case' 0 N--CA 1.436 -1.163 0 C-N-CA 125.134 1.374 . . . . 0.0 112.497 -168.552 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 21.7 tp60 -61.15 -24.62 66.42 Favored 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 123.6 0.76 . . . . 0.0 111.181 -179.958 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -63.42 -56.13 18.71 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.48 0.712 . . . . 0.0 110.215 169.018 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -60.6 -37.85 82.75 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.475 0.71 . . . . 0.0 110.389 -176.423 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.41 -39.84 67.7 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 125.48 1.512 . . . . 0.0 113.759 170.039 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.1 m -61.08 -45.18 95.78 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 123.052 0.22 . . . . 0.0 110.445 171.873 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 32.0 mm-40 -63.86 -27.82 69.43 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-O 117.801 -1.095 . . . . 0.0 112.186 179.417 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 43.1 mm -56.33 -50.62 70.88 Favored 'Isoleucine or valine' 0 C--N 1.341 0.227 0 CA-C-N 120.106 1.321 . . . . 0.0 109.516 170.541 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 47.4 mm-40 -59.13 -56.08 26.75 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 107.218 -1.401 . . . . 0.0 107.218 -175.099 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 24.7 mttm -70.79 -30.67 67.2 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 118.366 -0.826 . . . . 0.0 111.317 -172.15 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 26.0 t -56.86 -46.97 81.44 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 168.571 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.2 -43.99 92.24 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.471 179.877 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -58.17 -46.95 84.84 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 119.434 1.015 . . . . 0.0 111.114 173.378 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.91 -14.8 56.45 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 176.152 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 56.8 m-80 -122.76 10.91 9.67 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.826 1.25 . . . . 0.0 111.439 -173.693 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.9 m 55.5 41.14 31.12 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 122.56 1.171 . . . . 0.0 110.817 177.758 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.255 6.5 m-85 71.85 12.86 6.15 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 128.544 2.738 . . . . 0.0 114.095 169.816 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 61.3 mtm -72.9 85.71 1.26 Allowed 'General case' 0 N--CA 1.437 -1.121 0 C-N-CA 125.323 1.449 . . . . 0.0 109.166 171.938 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -52.3 -25.66 10.1 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.214 1.006 . . . . 0.0 111.25 169.826 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.2 m -52.65 -36.7 57.24 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 127.145 2.178 . . . . 0.0 113.003 170.501 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 63.1 mttt -83.72 -40.85 18.34 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.588 0.755 . . . . 0.0 109.827 175.064 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 82.9 m -72.04 6.22 2.26 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.475 1.11 . . . . 0.0 113.341 179.433 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 67.7 mm-40 -56.29 -29.18 60.85 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 121.141 -0.974 . . . . 0.0 110.878 167.264 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.97 -55.03 37.7 Favored 'General case' 0 C--N 1.345 0.372 0 C-N-CA 125.285 1.434 . . . . 0.0 111.636 173.799 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.2 p -74.99 -28.75 21.33 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.677 0 C-N-CA 123.549 0.74 . . . . 0.0 109.742 -175.229 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 35.6 mt -61.55 -47.9 91.24 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 168.853 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -50.76 -40.74 55.61 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 123.597 0.56 . . . . 0.0 110.328 173.456 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -68.64 -39.98 80.49 Favored 'General case' 0 N--CA 1.434 -1.27 0 C-N-CA 119.996 -0.682 . . . . 0.0 111.065 -178.943 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.411 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.3 mt -66.06 -38.94 89.59 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 117.688 -1.149 . . . . 0.0 111.058 174.7 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.48 ' HE ' ' HG2' ' A' ' 57' ' ' GLU . 3.6 ptm180 -67.72 -40.11 84.24 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 120.019 1.281 . . . . 0.0 110.112 179.155 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt -63.22 -42.32 99.24 Favored 'General case' 0 C--N 1.342 0.282 0 C-N-CA 123.131 0.572 . . . . 0.0 110.377 176.191 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 51.8 t -58.04 -51.59 69.04 Favored 'General case' 0 C--O 1.218 -0.589 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 172.298 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.7 t -57.83 -46.09 85.22 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 123.765 0.826 . . . . 0.0 112.069 -173.167 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.67 -0.51 7.02 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.438 -0.801 . . . . 0.0 113.149 -177.782 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.527 ' HB3' ' CE2' ' A' ' 42' ' ' TYR . 17.9 tt0 -83.7 -9.7 58.67 Favored 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 123.722 0.809 . . . . 0.0 111.013 175.799 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.527 ' CE2' ' HB3' ' A' ' 41' ' ' GLN . 80.8 m-85 -139.08 160.4 62.74 Favored Pre-proline 0 N--CA 1.445 -0.724 0 C-N-CA 124.766 1.226 . . . . 0.0 111.725 -167.682 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -68.05 132.47 26.33 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 N-CA-C 105.956 -2.363 . . . . 0.0 105.956 165.758 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -50.27 -42.22 51.85 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.355 1.243 . . . . 0.0 114.355 -167.026 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.78 -11.63 31.03 Favored Glycine 0 CA--C 1.531 1.051 0 CA-C-O 119.081 -0.844 . . . . 0.0 113.555 -178.87 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.61 -19.43 65.77 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 118.916 1.358 . . . . 0.0 112.361 172.471 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.9 t -145.34 136.77 25.13 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-O 122.964 1.364 . . . . 0.0 111.912 -176.929 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.7 t -69.93 -54.24 19.99 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.635 0 CA-C-N 113.697 -1.592 . . . . 0.0 108.701 -179.701 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.6 m -61.34 -38.3 79.61 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 C-N-CA 122.668 0.387 . . . . 0.0 110.232 -179.2 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 11.2 t -66.6 -37.72 85.48 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.726 0.81 . . . . 0.0 109.751 177.354 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.5 m -64.82 -20.96 66.68 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 119.036 -0.507 . . . . 0.0 111.367 173.02 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -80.76 -23.67 59.53 Favored Glycine 0 C--N 1.345 1.031 0 CA-C-N 118.918 0.781 . . . . 0.0 112.3 169.161 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.411 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -80.88 -49.58 10.85 Favored 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 125.052 1.341 . . . . 0.0 114.04 -166.876 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -63.41 -19.6 64.82 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.549 176.105 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -76.5 -47.06 24.05 Favored 'General case' 0 C--N 1.346 0.429 0 C-N-CA 123.541 0.736 . . . . 0.0 109.947 166.525 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -53.19 -39.15 63.45 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.404 0.682 . . . . 0.0 111.041 174.111 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.48 ' HG2' ' HE ' ' A' ' 36' ' ' ARG . 34.8 mt-10 -64.43 -31.15 72.24 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 125.251 1.42 . . . . 0.0 112.114 -178.516 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -60.85 -41.52 96.0 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 169.468 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -59.2 -44.83 92.23 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 122.735 0.414 . . . . 0.0 110.284 175.211 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -62.24 -39.76 93.92 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 123.267 0.627 . . . . 0.0 110.355 179.346 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 37.2 mt -64.41 -28.48 69.71 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 117.997 -1.001 . . . . 0.0 112.318 174.191 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 30.8 p -70.05 -48.43 57.89 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 120.181 1.355 . . . . 0.0 110.184 168.745 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 33.8 mtp180 -62.99 -43.36 99.0 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 124.35 1.06 . . . . 0.0 111.482 -173.111 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -148.74 95.82 2.48 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 125.122 1.369 . . . . 0.0 107.802 170.916 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 5.0 m -64.28 136.02 56.78 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 173.835 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -173.47 177.95 2.46 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 126.525 1.93 . . . . 0.0 107.833 -175.399 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 39.6 t -70.17 43.19 0.06 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.693 1.597 . . . . 0.0 112.267 171.623 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp . . . . . 0 C--N 1.342 0.266 0 C-N-CA 125.308 1.443 . . . . 0.0 110.305 -175.106 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.5 mmt . . . . . 0 CA--C 1.538 0.515 0 CA-C-O 118.758 -0.639 . . . . 0.0 110.311 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -68.65 108.09 1.79 Allowed 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 122.585 2.19 . . . . 0.0 110.111 -176.121 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -135.09 -55.3 0.81 Allowed 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 126.927 2.091 . . . . 0.0 108.662 179.236 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -138.8 155.02 48.5 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 104.531 -2.396 . . . . 0.0 104.531 167.804 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.1 t0 -114.46 93.5 32.35 Favored Pre-proline 0 CA--C 1.536 0.418 0 C-N-CA 123.891 0.876 . . . . 0.0 109.349 -174.051 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -57.5 -32.72 94.95 Favored 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 124.09 3.193 . . . . 0.0 112.639 -175.594 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 95.3 m -94.23 -11.94 29.22 Favored 'General case' 0 N--CA 1.436 -1.15 0 C-N-CA 125.085 1.354 . . . . 0.0 113.497 -168.899 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 24.6 tp60 -62.5 -27.49 69.18 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 122.767 0.427 . . . . 0.0 110.602 178.224 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.45 -56.99 14.95 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.666 0.786 . . . . 0.0 108.92 169.579 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -64.01 -36.34 83.65 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 121.868 -0.52 . . . . 0.0 110.556 -176.722 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -60.24 -36.75 78.44 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.261 1.025 . . . . 0.0 112.472 172.619 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.6 m -65.72 -41.78 91.85 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 118.062 0.392 . . . . 0.0 111.031 169.248 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -62.61 -27.49 69.24 Favored 'General case' 0 C--O 1.226 -0.159 0 CA-C-O 117.639 -1.172 . . . . 0.0 112.159 177.907 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 46.2 mm -55.24 -52.37 46.03 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-N 120.098 1.317 . . . . 0.0 109.372 169.895 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 46.9 mm-40 -61.07 -49.75 76.1 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 -173.023 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.4 mtpm? -70.41 -37.37 74.43 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.236 1.014 . . . . 0.0 111.825 -176.015 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 12.9 t -54.27 -43.52 71.06 Favored 'General case' 0 CA--C 1.513 -0.458 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 170.134 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.94 -45.95 89.2 Favored 'General case' 0 N--CA 1.441 -0.909 0 O-C-N 123.57 0.544 . . . . 0.0 109.644 -178.075 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 -64.38 -41.75 96.51 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 119.138 0.881 . . . . 0.0 110.604 179.291 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.39 -11.24 14.51 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 171.833 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 55.2 m-80 -127.17 10.45 6.87 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.216 1.406 . . . . 0.0 112.105 -176.567 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 5.4 m 55.1 40.93 32.03 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 122.554 1.168 . . . . 0.0 111.859 -179.904 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.257 7.1 m-85 74.03 13.46 4.08 Favored 'General case' 0 N--CA 1.443 -0.796 0 C-N-CA 128.827 2.851 . . . . 0.0 114.371 168.464 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 67.5 mtm -70.07 84.3 0.52 Allowed 'General case' 0 N--CA 1.441 -0.909 0 C-N-CA 125.063 1.345 . . . . 0.0 109.708 170.248 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -54.26 -24.88 20.52 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.301 0.64 . . . . 0.0 111.499 172.809 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 8.4 t -56.69 -34.93 67.9 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.304 1.042 . . . . 0.0 112.42 172.656 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.9 mmtm -72.99 -46.17 53.76 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.997 0.919 . . . . 0.0 108.527 173.176 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 84.0 m -72.05 1.65 7.02 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 124.363 1.065 . . . . 0.0 113.035 -174.853 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 77.3 mm-40 -57.94 -23.85 55.34 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 120.02 1.282 . . . . 0.0 110.364 166.047 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.58 -56.55 20.76 Favored 'General case' 0 C--N 1.347 0.477 0 C-N-CA 126.043 1.737 . . . . 0.0 111.692 169.5 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.4 p -76.63 -26.23 16.43 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 C-N-CA 123.43 0.692 . . . . 0.0 109.932 -174.932 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 60.3 mt -61.52 -46.69 96.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 167.829 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -54.84 -38.98 68.09 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 119.291 0.951 . . . . 0.0 112.285 171.062 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -67.7 -39.43 84.38 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 118.771 0.714 . . . . 0.0 110.478 178.796 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.477 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -66.55 -27.08 67.47 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 124.932 1.293 . . . . 0.0 109.003 175.918 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 7.9 mmt-85 -70.79 -48.79 52.39 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 176.315 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 28.1 mmtp -60.91 -31.24 70.76 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 123.575 0.547 . . . . 0.0 111.363 177.834 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 43.1 t -67.06 -58.79 4.24 Favored 'General case' 0 N--CA 1.44 -0.964 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 168.455 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 38.8 t -61.52 -39.58 91.54 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 121.115 -0.991 . . . . 0.0 113.17 -169.173 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.47 -2.02 12.62 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 -175.605 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.535 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 12.1 tt0 -94.63 -7.21 41.54 Favored 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 127.43 2.292 . . . . 0.0 111.448 -171.086 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.535 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 78.4 m-85 -138.77 161.18 59.78 Favored Pre-proline 0 N--CA 1.447 -0.602 0 C-N-CA 124.445 1.098 . . . . 0.0 112.063 -167.877 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -67.79 121.03 8.05 Favored 'Trans proline' 0 N--CA 1.456 -0.713 0 N-CA-C 104.792 -2.811 . . . . 0.0 104.792 164.436 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.9 mmtt -51.35 -33.06 27.94 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 -166.025 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.88 -14.89 32.62 Favored Glycine 0 CA--C 1.533 1.18 0 C-N-CA 124.334 0.969 . . . . 0.0 113.913 176.313 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.9 tpm_? -57.12 -31.45 65.32 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 125.32 1.448 . . . . 0.0 111.247 169.446 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.6 t -136.64 134.8 37.71 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-O 123.372 1.558 . . . . 0.0 112.62 -168.781 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 15.6 t -68.91 -54.04 22.78 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.699 0 CA-C-N 112.789 -2.005 . . . . 0.0 108.425 177.044 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 5.1 m -60.72 -43.5 95.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.47 0 CA-C-O 118.241 -0.885 . . . . 0.0 109.814 -177.969 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 43.4 t -63.11 -32.05 73.34 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.427 1.491 . . . . 0.0 110.284 179.949 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.2 m -68.81 -27.72 66.11 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.059 0.544 . . . . 0.0 111.079 172.108 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.99 -35.17 78.22 Favored Glycine 0 C--N 1.345 1.031 0 CA-C-O 123.794 1.774 . . . . 0.0 111.525 167.357 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.477 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 1.5 t80 -80.78 -40.34 25.27 Favored 'General case' 0 N--CA 1.415 -2.216 0 N-CA-C 117.162 2.282 . . . . 0.0 117.162 -162.687 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -68.24 -21.77 64.81 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 118.64 -0.695 . . . . 0.0 110.337 169.527 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -74.9 -37.7 62.03 Favored 'General case' 0 C--N 1.349 0.554 0 CA-C-N 119.439 1.018 . . . . 0.0 109.671 166.874 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -58.72 -34.42 71.32 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 119.051 0.841 . . . . 0.0 110.707 170.465 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -62.93 -33.79 76.08 Favored 'General case' 0 CA--C 1.532 0.27 0 O-C-N 121.728 -0.608 . . . . 0.0 111.131 178.099 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -64.35 -29.86 70.92 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.237 1.015 . . . . 0.0 111.44 173.73 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -76.18 -43.57 42.02 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 121.759 -0.588 . . . . 0.0 110.246 169.258 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -66.0 -32.18 73.52 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 121.646 -0.659 . . . . 0.0 111.451 -175.257 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.8 pp -62.76 -5.68 2.98 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 176.363 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 46.6 p -64.19 -53.1 54.58 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.7 1.136 . . . . 0.0 109.249 167.386 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 41.2 ttp180 -58.61 -32.38 68.95 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 125.531 1.532 . . . . 0.0 110.389 169.393 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 58.96 33.06 22.81 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 125.106 1.363 . . . . 0.0 111.689 171.973 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 27.3 m -165.14 172.07 13.0 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 127.403 2.281 . . . . 0.0 107.139 174.985 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . 39.13 50.19 1.81 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.161 1.385 . . . . 0.0 111.494 -173.057 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 69.8 m -127.86 28.98 5.51 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 126.052 1.741 . . . . 0.0 111.175 -171.171 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.162 0 C-N-CA 126.298 1.839 . . . . 0.0 108.193 179.421 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 mmt . . . . . 0 CA--C 1.536 0.421 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -75.63 24.93 0.41 Allowed 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 123.767 2.978 . . . . 0.0 114.334 -174.672 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -74.04 22.08 0.09 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 128.638 2.775 . . . . 0.0 113.325 -174.693 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 54.7 tptt -59.2 150.1 26.49 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.379 1.072 . . . . 0.0 110.085 177.358 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.0 t0 -123.77 93.85 46.78 Favored Pre-proline 0 N--CA 1.445 -0.723 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 168.784 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -59.04 -18.3 42.6 Favored 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 124.827 3.685 . . . . 0.0 115.053 -172.354 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 65.5 m -110.55 -8.49 14.63 Favored 'General case' 0 N--CA 1.438 -1.069 0 C-N-CA 126.888 2.075 . . . . 0.0 113.206 -168.473 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 18.5 tp60 -66.54 -23.97 66.3 Favored 'General case' 0 N--CA 1.445 -0.717 0 O-C-N 121.916 -0.49 . . . . 0.0 111.987 -173.258 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -69.07 -45.09 71.21 Favored 'General case' 0 C--O 1.225 -0.191 0 CA-C-O 121.827 0.822 . . . . 0.0 110.069 174.433 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.9 mp0 -65.74 -40.75 92.44 Favored 'General case' 0 N--CA 1.443 -0.807 0 C-N-CA 127.317 2.247 . . . . 0.0 108.098 -175.318 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.66 -44.43 73.28 Favored 'General case' 0 C--N 1.341 0.225 0 C-N-CA 125.474 1.51 . . . . 0.0 112.504 168.556 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 70.9 m -59.27 -43.87 92.47 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 110.424 -0.213 . . . . 0.0 110.424 175.399 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -63.96 -21.02 66.3 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 117.584 -1.198 . . . . 0.0 112.518 178.73 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 26.3 mm -59.75 -54.97 27.22 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.193 0 CA-C-N 120.587 1.54 . . . . 0.0 108.942 171.788 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -57.61 -54.25 49.03 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 115.163 -0.926 . . . . 0.0 108.848 178.343 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 57.2 mmtt -68.57 -30.64 69.45 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 118.567 -1.253 . . . . 0.0 111.592 -172.757 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 19.9 t -56.82 -48.85 77.05 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 168.789 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.76 -46.81 84.01 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 123.099 0.56 . . . . 0.0 110.477 179.55 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -57.22 -45.96 83.37 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.708 0.803 . . . . 0.0 111.267 174.204 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.85 -12.78 57.03 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 175.387 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -124.21 8.6 8.54 Favored 'General case' 0 C--N 1.342 0.264 0 C-N-CA 124.592 1.157 . . . . 0.0 112.29 -172.524 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 58.6 40.1 23.96 Favored 'General case' 0 C--N 1.345 0.389 0 CA-C-O 122.414 1.102 . . . . 0.0 110.846 179.42 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.264 7.1 m-85 72.09 13.88 5.77 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 127.849 2.459 . . . . 0.0 114.612 168.72 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 66.0 mtm -69.83 85.84 0.5 Allowed 'General case' 0 N--CA 1.441 -0.91 0 C-N-CA 125.063 1.345 . . . . 0.0 110.107 170.148 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -53.9 -24.47 16.24 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.505 0.722 . . . . 0.0 111.698 170.643 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.1 m -53.65 -40.56 65.97 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 126.299 1.839 . . . . 0.0 112.335 170.631 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.4 mmtm -71.85 -47.28 54.15 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 124.201 1.0 . . . . 0.0 108.754 174.132 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 70.9 m -74.22 4.29 5.93 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 124.78 1.232 . . . . 0.0 113.418 -173.626 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 59.4 mm-40 -54.9 -32.29 60.89 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 119.131 0.878 . . . . 0.0 109.894 166.846 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.96 -53.0 63.0 Favored 'General case' 0 C--N 1.345 0.39 0 C-N-CA 124.582 1.153 . . . . 0.0 111.676 174.709 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.7 p -77.54 -27.15 15.46 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.78 0 C-N-CA 123.439 0.696 . . . . 0.0 110.027 -174.296 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 53.7 mt -63.18 -44.03 99.13 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 168.581 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -57.92 -29.74 65.37 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 118.966 0.803 . . . . 0.0 111.768 173.193 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -70.17 -47.5 61.34 Favored 'General case' 0 N--CA 1.443 -0.822 0 CA-C-N 118.69 0.677 . . . . 0.0 111.557 173.458 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.7 mt -61.9 -31.6 71.91 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 118.958 0.799 . . . . 0.0 110.239 176.759 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.73 -59.72 4.96 Favored 'General case' 0 CA--C 1.52 -0.208 0 C-N-CA 125.948 1.699 . . . . 0.0 109.956 175.2 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -63.47 -34.79 78.55 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 114.715 -1.13 . . . . 0.0 110.922 -177.256 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 42.8 t -62.22 -51.64 66.97 Favored 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 169.726 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 52.5 t -64.36 -48.73 74.41 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 123.7 0.8 . . . . 0.0 112.003 -170.173 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.85 -1.3 5.28 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 124.216 1.006 . . . . 0.0 112.339 -175.707 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.447 ' HB3' ' CE2' ' A' ' 42' ' ' TYR . 2.2 tp-100 -81.32 -8.22 59.71 Favored 'General case' 0 N--CA 1.437 -1.085 0 C-N-CA 125.005 1.322 . . . . 0.0 111.288 175.033 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.447 ' CE2' ' HB3' ' A' ' 41' ' ' GLN . 82.0 m-85 -142.04 160.4 55.52 Favored Pre-proline 0 N--CA 1.443 -0.818 0 C-N-CA 125.015 1.326 . . . . 0.0 111.907 -167.438 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -69.37 124.95 11.76 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 N-CA-C 105.641 -2.484 . . . . 0.0 105.641 165.234 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -47.11 -35.75 7.5 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 116.205 1.928 . . . . 0.0 116.205 -166.947 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.9 -14.56 17.06 Favored Glycine 0 CA--C 1.534 1.265 0 C-N-CA 124.515 1.055 . . . . 0.0 114.051 177.946 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 9.0 tpm_? -54.83 -28.46 49.82 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 126.401 1.88 . . . . 0.0 112.348 168.62 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.0 t -149.69 140.37 22.61 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-O 122.623 1.202 . . . . 0.0 111.531 -168.968 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 10.5 t -69.47 -54.24 20.67 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.691 0 CA-C-N 114.019 -1.446 . . . . 0.0 108.617 178.028 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.5 m -61.07 -40.49 85.85 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 C-N-CA 122.916 0.486 . . . . 0.0 110.334 -177.542 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 12.6 t -67.1 -36.04 81.07 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.716 1.206 . . . . 0.0 109.905 177.473 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 53.3 m -65.51 -27.59 68.58 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 121.773 -0.579 . . . . 0.0 110.873 172.476 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -71.14 -27.91 71.12 Favored Glycine 0 C--N 1.345 1.047 0 CA-C-O 122.125 0.847 . . . . 0.0 112.06 169.425 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -80.95 -47.66 13.37 Favored 'General case' 0 N--CA 1.428 -1.574 0 C-N-CA 125.727 1.611 . . . . 0.0 114.801 -166.965 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -63.2 -25.48 68.36 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 119.517 -0.873 . . . . 0.0 110.152 173.626 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 10.1 mtmp? -71.03 -37.21 72.57 Favored 'General case' 0 C--N 1.347 0.465 0 CA-C-N 118.984 0.811 . . . . 0.0 110.814 167.796 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -57.94 -40.11 79.69 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 118.919 0.781 . . . . 0.0 110.107 169.139 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -66.31 -38.95 88.89 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 119.46 1.027 . . . . 0.0 111.318 175.3 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -61.36 -37.54 83.71 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.977 0.808 . . . . 0.0 110.95 170.093 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -64.72 -36.72 85.19 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 118.948 0.795 . . . . 0.0 111.689 172.416 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . 0.452 ' ND2' ' HE ' ' A' ' 63' ' ' ARG . 1.1 m-80 -61.38 -26.32 67.76 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 123.872 0.869 . . . . 0.0 112.269 179.814 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 85.3 mt -53.92 -27.18 29.11 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.263 0.625 . . . . 0.0 112.281 169.808 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 27.7 p -81.3 -46.77 14.25 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 124.5 1.12 . . . . 0.0 111.313 173.644 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.452 ' HE ' ' ND2' ' A' ' 60' ' ' ASN . 29.0 mtm180 -62.78 -46.98 85.5 Favored 'General case' 0 C--O 1.233 0.187 0 C-N-CA 124.886 1.274 . . . . 0.0 110.966 -176.116 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -78.09 62.48 2.85 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.661 1.584 . . . . 0.0 110.352 -175.131 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.8 m 55.98 -161.04 0.19 Allowed 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.158 0.983 . . . . 0.0 111.102 -178.098 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.75 29.45 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.669 1.587 . . . . 0.0 115.19 -177.317 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 44.4 m -72.36 26.64 0.05 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 127.216 2.206 . . . . 0.0 113.722 -178.252 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 48.8 mmtm . . . . . 0 N--CA 1.454 -0.264 0 C-N-CA 125.89 1.676 . . . . 0.0 109.954 -170.076 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.6 mtt . . . . . 0 CA--C 1.538 0.487 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -49.93 136.25 36.27 Favored 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 122.92 2.414 . . . . 0.0 111.227 171.381 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -71.57 40.73 0.07 Allowed 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 127.473 2.309 . . . . 0.0 113.082 -174.928 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 35.3 mmtp -61.67 126.8 28.63 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 106.761 -1.57 . . . . 0.0 106.761 169.021 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -91.9 100.27 3.3 Favored Pre-proline 0 CA--C 1.537 0.464 0 C-N-CA 124.106 0.962 . . . . 0.0 109.125 -168.862 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_exo -60.57 -31.34 92.18 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 123.599 2.866 . . . . 0.0 112.781 -171.809 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 77.7 m -94.25 -13.17 26.82 Favored 'General case' 0 N--CA 1.438 -1.069 0 C-N-CA 125.194 1.398 . . . . 0.0 112.558 -169.45 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.0 tp60 -61.7 -25.23 67.29 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 123.131 0.572 . . . . 0.0 110.855 177.804 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.8 tttm -60.14 -56.58 19.83 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.824 1.25 . . . . 0.0 109.962 168.118 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -62.99 -36.97 85.3 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.355 0.662 . . . . 0.0 110.568 -177.992 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.63 -43.95 72.75 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 124.854 1.262 . . . . 0.0 112.214 169.388 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 80.8 m -57.93 -43.5 86.32 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 121.174 -0.21 . . . . 0.0 110.965 172.96 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -63.61 -23.56 67.43 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-O 117.751 -1.119 . . . . 0.0 112.491 178.728 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 26.4 mm -59.36 -54.72 30.39 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.226 0 CA-C-N 120.128 1.331 . . . . 0.0 108.833 172.531 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 33.0 mm-40 -59.2 -53.07 62.49 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.422 179.467 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.34 -33.08 74.93 Favored 'General case' 0 C--N 1.333 -0.111 0 C-N-CA 118.703 -1.199 . . . . 0.0 111.568 -175.811 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 23.6 t -56.1 -47.68 77.59 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 119.271 0.941 . . . . 0.0 108.944 169.329 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.07 -46.83 84.78 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 123.516 0.727 . . . . 0.0 110.682 178.8 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -57.4 -43.83 84.05 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.72 0.808 . . . . 0.0 111.305 173.782 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.5 -11.96 59.19 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.076 0.95 . . . . 0.0 113.477 174.631 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 -125.66 8.63 7.62 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 124.719 1.208 . . . . 0.0 112.358 -172.029 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.1 m 58.56 40.17 24.0 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-N 119.494 1.043 . . . . 0.0 110.903 179.78 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.257 6.9 m-85 71.71 13.34 6.24 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 127.654 2.382 . . . . 0.0 114.779 168.614 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 64.4 mtm -70.17 84.61 0.54 Allowed 'General case' 0 N--CA 1.441 -0.892 0 C-N-CA 125.184 1.394 . . . . 0.0 109.722 170.082 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -54.63 -24.27 20.78 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 119.063 -0.494 . . . . 0.0 111.637 172.335 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.8 m -51.77 -44.05 63.22 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 126.452 1.901 . . . . 0.0 112.141 170.076 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.4 mmtm -67.75 -48.49 66.26 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 124.175 0.99 . . . . 0.0 108.687 174.651 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.2 m -72.73 2.71 6.1 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 124.973 1.309 . . . . 0.0 113.302 -174.748 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 45.9 mm-40 -56.3 -26.64 52.82 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 120.078 1.308 . . . . 0.0 111.281 168.159 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.34 -51.38 69.64 Favored 'General case' 0 C--N 1.345 0.392 0 C-N-CA 125.537 1.535 . . . . 0.0 112.184 169.951 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.7 p -80.71 -26.09 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.888 0 C-N-CA 123.698 0.799 . . . . 0.0 109.657 -174.759 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.5 mp -60.51 -48.52 88.15 Favored 'Isoleucine or valine' 0 C--N 1.35 0.593 0 N-CA-C 105.689 -1.967 . . . . 0.0 105.689 166.214 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.98 -37.63 61.48 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 123.212 0.605 . . . . 0.0 110.886 176.514 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -70.91 -39.49 72.69 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 120.072 -0.651 . . . . 0.0 110.974 179.669 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.454 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.0 OUTLIER -64.4 -36.83 85.41 Favored 'General case' 0 C--N 1.342 0.279 0 CA-C-O 117.877 -1.059 . . . . 0.0 110.765 174.663 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.474 ' HE ' ' HG2' ' A' ' 57' ' ' GLU . 0.0 OUTLIER -68.12 -40.5 82.51 Favored 'General case' 0 C--N 1.341 0.219 0 CA-C-N 119.775 1.17 . . . . 0.0 110.215 178.347 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 57.2 mttp -63.49 -39.55 94.73 Favored 'General case' 0 C--N 1.341 0.218 0 CA-C-O 119.232 -0.413 . . . . 0.0 111.012 175.536 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.1 t -59.33 -52.74 64.34 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 171.937 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.1 t -57.74 -48.87 78.4 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 124.034 0.934 . . . . 0.0 112.048 -171.663 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.12 -1.25 7.26 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.241 -0.89 . . . . 0.0 112.722 -175.148 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.509 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 21.2 tt0 -84.15 -12.09 55.52 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 125.203 1.401 . . . . 0.0 111.345 179.088 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.509 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 76.4 m-85 -133.02 157.87 77.26 Favored Pre-proline 0 N--CA 1.447 -0.617 0 C-N-CA 124.174 0.99 . . . . 0.0 112.003 -168.146 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -67.31 109.43 1.78 Allowed 'Trans proline' 0 N--CA 1.453 -0.898 0 N-CA-C 104.878 -2.778 . . . . 0.0 104.878 165.501 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.88 -27.48 0.53 Allowed 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 117.199 2.296 . . . . 0.0 117.199 -166.773 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.47 -18.44 29.92 Favored Glycine 0 CA--C 1.536 1.369 0 CA-C-N 119.512 1.051 . . . . 0.0 113.571 172.479 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.26 -21.19 63.67 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.946 2.098 . . . . 0.0 112.516 170.93 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.6 t -148.06 134.59 19.75 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 123.566 1.651 . . . . 0.0 114.152 -170.434 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.8 t -72.43 -55.33 13.52 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.638 0 CA-C-N 112.552 -2.113 . . . . 0.0 108.886 178.017 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 5.9 m -59.2 -40.88 82.21 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 C-N-CA 122.684 0.394 . . . . 0.0 110.029 -179.178 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 13.3 t -63.78 -37.57 87.88 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.524 1.13 . . . . 0.0 109.713 178.021 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 52.7 m -67.64 -17.11 64.49 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 118.727 -0.654 . . . . 0.0 112.319 175.035 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -86.04 -20.57 55.1 Favored Glycine 0 C--N 1.344 0.991 0 CA-C-N 119.148 0.886 . . . . 0.0 112.205 167.776 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.454 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -80.21 -43.13 22.0 Favored 'General case' 0 N--CA 1.418 -2.052 0 N-CA-C 113.959 1.096 . . . . 0.0 113.959 -166.269 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -62.27 -17.72 59.31 Favored 'General case' 0 C--N 1.319 -0.752 0 O-C-N 123.975 0.797 . . . . 0.0 110.68 179.916 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 57.8 mttm -71.39 -52.94 15.86 Favored 'General case' 0 C--N 1.345 0.408 0 CA-C-N 118.654 0.661 . . . . 0.0 109.466 167.244 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -62.17 -25.73 67.93 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.013 1.325 . . . . 0.0 112.552 176.526 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.474 ' HG2' ' HE ' ' A' ' 36' ' ' ARG . 15.8 mt-10 -63.69 -35.18 79.71 Favored 'General case' 0 N--CA 1.455 -0.183 0 O-C-N 121.025 -1.047 . . . . 0.0 110.913 173.599 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.8 mm-40 -62.89 -45.7 91.29 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 172.025 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.6 tp10 -58.69 -36.4 74.15 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 112.411 0.522 . . . . 0.0 112.411 175.505 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -72.79 -54.26 9.33 Favored 'General case' 0 N--CA 1.453 -0.28 0 O-C-N 121.468 -0.77 . . . . 0.0 111.164 175.88 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.2 pp -65.97 -32.37 73.82 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 118.796 0.725 . . . . 0.0 111.028 -171.712 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -64.59 -43.14 94.79 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.439 0.563 . . . . 0.0 109.709 172.633 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 75.9 mtm180 -66.25 -35.03 79.36 Favored 'General case' 0 CA--C 1.534 0.331 0 O-C-N 121.245 -0.909 . . . . 0.0 111.051 176.1 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.33 18.0 0.75 Allowed 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.043 1.737 . . . . 0.0 113.866 178.024 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 89.1 p -159.55 -170.12 2.82 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.301 1.441 . . . . 0.0 110.462 -176.557 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.12 87.95 0.16 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.404 1.082 . . . . 0.0 108.643 169.699 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 9.6 m -52.05 102.33 0.05 OUTLIER 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 126.652 1.981 . . . . 0.0 115.604 -168.115 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 43.7 mmtm . . . . . 0 N--CA 1.448 -0.526 0 C-N-CA 125.05 1.34 . . . . 0.0 107.665 167.624 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 73.4 mtm . . . . . 0 CA--C 1.539 0.549 0 CA-C-O 118.658 -0.687 . . . . 0.0 109.583 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -67.61 104.12 0.91 Allowed 'Trans proline' 0 C--N 1.35 0.652 0 C-N-CA 124.099 3.2 . . . . 0.0 111.769 -171.584 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 12.3 mt-30 -145.84 171.99 13.98 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 128.759 2.823 . . . . 0.0 107.444 -176.236 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -63.31 105.7 0.78 Allowed 'General case' 0 C--N 1.341 0.215 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 168.327 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -93.73 99.53 3.61 Favored Pre-proline 0 CA--C 1.539 0.524 0 C-N-CA 125.189 1.396 . . . . 0.0 111.814 -166.33 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -63.85 -28.42 67.51 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 123.646 2.897 . . . . 0.0 112.671 -175.509 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 13.1 m -91.44 -8.1 48.75 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 123.418 0.687 . . . . 0.0 112.145 -176.927 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 20.1 tp60 -63.48 -25.04 68.08 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 119.13 0.877 . . . . 0.0 110.527 -179.514 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -60.04 -52.32 65.89 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.506 1.122 . . . . 0.0 109.589 169.454 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -65.37 -38.71 90.89 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.616 -0.678 . . . . 0.0 110.244 -179.442 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -59.97 -35.4 74.92 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.136 0.974 . . . . 0.0 112.522 172.329 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 95.6 m -65.13 -43.55 91.55 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.229 0.468 . . . . 0.0 110.936 169.207 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 -62.75 -25.54 68.25 Favored 'General case' 0 C--O 1.225 -0.232 0 CA-C-O 117.725 -1.131 . . . . 0.0 112.221 178.367 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 45.2 mm -56.72 -50.3 74.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-N 120.187 1.358 . . . . 0.0 109.439 169.56 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 44.9 mm-40 -60.68 -54.32 46.74 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 -175.729 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 27.0 mttm -70.53 -30.92 67.8 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 118.56 -0.733 . . . . 0.0 111.623 -173.29 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 21.5 t -56.98 -46.0 82.52 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 107.934 -1.136 . . . . 0.0 107.934 168.666 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.0 -43.9 91.58 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-O 118.297 -0.859 . . . . 0.0 110.372 179.722 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -58.51 -46.51 86.6 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 119.475 1.034 . . . . 0.0 111.129 173.07 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.42 -15.28 60.3 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 175.953 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.3 m-80 -122.81 11.05 9.65 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.925 1.29 . . . . 0.0 111.43 -172.931 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.9 m 55.98 40.74 30.36 Favored 'General case' 0 C--N 1.346 0.44 0 CA-C-O 122.556 1.17 . . . . 0.0 110.817 177.315 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.253 6.7 m-85 71.85 12.59 6.17 Favored 'General case' 0 N--CA 1.444 -0.758 0 C-N-CA 128.466 2.706 . . . . 0.0 114.068 169.713 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 62.0 mtm -73.26 83.99 1.38 Allowed 'General case' 0 N--CA 1.437 -1.123 0 C-N-CA 125.445 1.498 . . . . 0.0 109.159 172.214 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -53.46 -24.01 11.68 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.022 0.929 . . . . 0.0 111.465 172.115 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.1 m -51.88 -41.29 61.78 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 126.131 1.773 . . . . 0.0 112.307 169.988 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 56.8 mttt -76.69 -42.5 41.35 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.234 0.614 . . . . 0.0 109.753 175.779 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.8 m -70.98 0.73 6.79 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 124.193 0.997 . . . . 0.0 113.275 -178.7 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 82.3 mm-40 -55.25 -27.44 46.44 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 119.935 1.243 . . . . 0.0 110.823 167.114 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.07 -60.57 3.54 Favored 'General case' 0 C--N 1.345 0.401 0 C-N-CA 125.637 1.575 . . . . 0.0 111.467 171.46 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.6 p -70.93 -29.46 37.38 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.694 0 C-N-CA 123.635 0.774 . . . . 0.0 109.979 -174.437 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 70.3 mt -58.63 -52.7 56.66 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 N-CA-C 105.869 -1.9 . . . . 0.0 105.869 168.842 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -58.79 -30.07 67.3 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 119.48 1.036 . . . . 0.0 113.187 175.921 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -71.27 -37.67 71.89 Favored 'General case' 0 N--CA 1.438 -1.072 0 C-N-CA 119.833 -0.747 . . . . 0.0 109.724 176.62 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.42 -30.74 71.82 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 124.811 1.244 . . . . 0.0 108.916 172.289 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.2 mmt85 -70.35 -49.58 47.84 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 -179.952 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 46.1 mttp -61.71 -36.57 81.29 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 124.257 1.023 . . . . 0.0 111.156 177.13 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 42.7 t -60.45 -54.04 50.27 Favored 'General case' 0 C--O 1.221 -0.429 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 169.357 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 51.5 t -61.49 -44.27 97.39 Favored 'General case' 0 CA--C 1.515 -0.379 0 C-N-CA 124.477 1.111 . . . . 0.0 112.202 -169.6 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.45 -3.14 16.31 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.18 -0.918 . . . . 0.0 113.112 -178.354 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.423 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 2.5 tp-100 -88.63 -2.48 58.62 Favored 'General case' 0 N--CA 1.439 -0.999 0 C-N-CA 124.219 1.008 . . . . 0.0 111.361 -175.783 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.423 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 63.2 m-85 -143.13 162.88 40.83 Favored Pre-proline 0 N--CA 1.443 -0.804 0 C-N-CA 127.364 2.266 . . . . 0.0 110.795 -168.882 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_exo -61.33 116.97 3.74 Favored 'Trans proline' 0 N--CA 1.456 -0.699 0 N-CA-C 105.706 -2.459 . . . . 0.0 105.706 166.231 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -51.84 -35.36 44.31 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 120.498 1.499 . . . . 0.0 114.655 -168.929 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -70.26 -4.61 51.13 Favored Glycine 0 CA--C 1.531 1.089 0 CA-C-O 118.258 -1.301 . . . . 0.0 114.143 178.395 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.97 -7.18 32.78 Favored 'General case' 0 CA--C 1.554 1.104 0 CA-C-N 120.044 1.922 . . . . 0.0 111.86 174.508 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.7 t -141.17 155.32 46.09 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 126.162 1.785 . . . . 0.0 110.404 -168.392 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 47.9 t -79.2 -60.92 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.562 0 C-N-CA 124.876 1.27 . . . . 0.0 108.801 171.197 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.5 m -60.37 -44.31 95.71 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 CA-C-O 119.073 -0.489 . . . . 0.0 110.044 -169.631 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 31.7 t -65.64 -29.39 69.96 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.177 1.391 . . . . 0.0 110.23 -179.737 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 69.6 m -69.68 -21.62 63.5 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 118.533 -0.746 . . . . 0.0 111.307 171.796 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -75.51 -39.23 35.82 Favored Glycine 0 C--N 1.344 1.009 0 CA-C-O 124.474 2.152 . . . . 0.0 110.681 166.976 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -76.69 -38.73 53.94 Favored 'General case' 0 N--CA 1.419 -1.998 0 CA-C-N 111.819 -2.19 . . . . 0.0 116.705 -163.721 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -65.4 -20.09 66.23 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 118.643 -0.694 . . . . 0.0 110.954 169.731 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 42.4 mmtm -72.88 -40.12 65.88 Favored 'General case' 0 C--N 1.347 0.491 0 CA-C-N 119.627 1.103 . . . . 0.0 109.32 167.677 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -55.36 -46.01 76.48 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 118.414 0.552 . . . . 0.0 110.161 170.757 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -60.76 -39.6 89.34 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-O 118.691 -0.671 . . . . 0.0 110.433 176.583 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -60.08 -36.22 76.89 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 119.204 0.911 . . . . 0.0 111.125 175.986 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -63.99 -48.98 74.28 Favored 'General case' 0 C--N 1.343 0.289 0 CA-C-N 118.659 0.663 . . . . 0.0 110.285 169.983 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -64.87 -29.13 70.06 Favored 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 123.756 0.822 . . . . 0.0 111.764 -173.943 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 58.1 mt -61.19 -17.51 53.46 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.832 0.853 . . . . 0.0 112.989 172.895 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 44.1 p -72.17 -49.0 39.21 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 120.05 1.296 . . . . 0.0 110.204 169.886 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 7.7 tmm_? -64.1 -31.07 72.13 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 127.231 2.212 . . . . 0.0 111.463 175.758 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . 0.284 17.9 pttm 48.48 -158.46 0.06 Allowed 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 128.277 2.631 . . . . 0.0 112.534 174.257 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.7 m 66.0 -166.59 0.22 Allowed 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 -167.125 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.64 138.83 57.61 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.774 -0.579 . . . . 0.0 112.052 -176.323 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -167.79 172.1 9.43 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 127.001 2.121 . . . . 0.0 106.686 168.599 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 20.7 ttmm . . . . . 0 N--CA 1.466 0.366 0 C-N-CA 125.572 1.549 . . . . 0.0 111.997 170.746 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 36.0 t0 . . . . . 0 N--CA 1.446 -0.647 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -55.91 -33.93 90.28 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 124.499 3.466 . . . . 0.0 113.068 -175.585 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.408 ' HB3' ' CD2' ' A' ' 35' ' ' LEU . 56.8 m -94.92 -13.2 25.61 Favored 'General case' 0 N--CA 1.435 -1.217 0 C-N-CA 125.815 1.646 . . . . 0.0 113.054 -169.165 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.6 tp60 -62.64 -25.94 68.37 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.695 0.68 . . . . 0.0 111.416 -177.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -61.21 -50.44 73.07 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.376 0.67 . . . . 0.0 110.195 172.387 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -64.47 -44.59 90.56 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 123.777 0.831 . . . . 0.0 109.149 179.268 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.59 -41.53 54.74 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 119.937 1.244 . . . . 0.0 113.035 174.38 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 84.6 m -56.56 -46.7 80.58 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 123.419 0.449 . . . . 0.0 110.128 174.053 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -60.28 -39.04 85.48 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 117.496 -1.24 . . . . 0.0 112.303 177.116 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 2.0 mp -59.16 -49.87 81.82 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 CA-C-N 120.451 1.478 . . . . 0.0 109.482 173.281 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 93.8 mm-40 -61.34 -51.35 69.18 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 -174.315 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 41.2 mtpt -68.89 -37.98 79.34 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 123.798 0.839 . . . . 0.0 111.945 -177.319 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 17.2 t -52.28 -46.45 65.87 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 169.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.57 -46.39 84.02 Favored 'General case' 0 N--CA 1.442 -0.856 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 -177.075 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.435 ' HA ' ' CE1' ' A' ' 23' ' ' TYR . 3.1 mm-40 -63.15 -44.2 96.2 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 118.999 0.818 . . . . 0.0 110.637 179.265 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -60.95 -14.11 20.49 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 113.193 0.812 . . . . 0.0 113.193 172.701 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 57.9 m-80 -122.34 11.51 10.04 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.59 1.556 . . . . 0.0 111.123 -177.415 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 12.6 m 51.6 43.31 29.86 Favored 'General case' 0 C--N 1.346 0.447 0 C-N-CA 125.026 1.33 . . . . 0.0 112.011 -179.256 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.435 ' CE1' ' HA ' ' A' ' 19' ' ' GLN 0.271 7.4 m-85 73.49 14.26 4.38 Favored 'General case' 0 N--CA 1.441 -0.891 0 C-N-CA 129.14 2.976 . . . . 0.0 113.976 169.145 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 64.7 mtm -69.88 85.03 0.49 Allowed 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 125.37 1.468 . . . . 0.0 110.351 170.057 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -55.33 -17.6 5.04 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 127.115 2.166 . . . . 0.0 111.179 168.557 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 68.8 m -60.75 -54.06 49.86 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.76 1.624 . . . . 0.0 110.346 168.136 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 57.6 mttt -67.3 -43.29 82.07 Favored 'General case' 0 C--O 1.231 0.128 0 O-C-N 121.799 -0.563 . . . . 0.0 109.846 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.5 m -71.09 2.69 4.19 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 117.234 -1.365 . . . . 0.0 113.164 175.736 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 59.0 mm-40 -53.6 -34.24 57.73 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 121.022 1.737 . . . . 0.0 111.432 169.728 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.08 -56.42 22.49 Favored 'General case' 0 C--N 1.342 0.271 0 CA-C-N 119.271 0.941 . . . . 0.0 111.308 177.711 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.9 p -73.21 -33.22 40.99 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.025 -174.911 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 35.9 mt -59.25 -44.05 91.18 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.467 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 170.525 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.54 -34.71 62.24 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 118.332 0.515 . . . . 0.0 111.172 173.962 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -72.09 -40.17 68.41 Favored 'General case' 0 N--CA 1.427 -1.581 0 C-N-CA 118.536 -1.266 . . . . 0.0 111.158 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.492 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.5 mt -65.01 -30.5 71.49 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 119.903 1.229 . . . . 0.0 111.75 173.55 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.95 -58.23 9.46 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 124.053 0.941 . . . . 0.0 108.879 174.735 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.48 -35.62 76.34 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 114.15 -1.386 . . . . 0.0 111.11 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 49.6 t -62.27 -50.11 72.99 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 123.52 0.728 . . . . 0.0 109.288 172.069 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 53.1 t -64.05 -48.07 77.72 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 123.905 0.882 . . . . 0.0 111.671 -172.242 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.408 ' HA ' ' HE3' ' A' ' 44' ' ' LYS . . . -67.45 -2.98 7.21 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 124.434 1.093 . . . . 0.0 112.706 -178.167 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.444 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 2.6 tp-100 -83.5 -5.87 59.29 Favored 'General case' 0 N--CA 1.439 -1.015 0 C-N-CA 124.87 1.268 . . . . 0.0 111.414 179.096 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.444 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 82.6 m-85 -138.81 161.83 56.15 Favored Pre-proline 0 N--CA 1.444 -0.767 0 C-N-CA 125.415 1.486 . . . . 0.0 110.508 -169.045 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -67.73 107.95 1.56 Allowed 'Trans proline' 0 N--CA 1.457 -0.664 0 N-CA-C 104.518 -2.916 . . . . 0.0 104.518 165.407 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.408 ' HE3' ' HA ' ' A' ' 40' ' ' ALA . 31.6 mmtm -38.08 -43.29 0.73 Allowed 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 117.04 2.237 . . . . 0.0 117.04 -163.918 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.19 -14.33 11.54 Favored Glycine 0 CA--C 1.537 1.429 0 C-N-CA 124.475 1.036 . . . . 0.0 114.109 177.137 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 29.1 tpt85 -48.83 -34.11 11.81 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 128.285 2.634 . . . . 0.0 112.168 170.306 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.3 t -138.78 140.86 38.76 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-O 121.939 0.876 . . . . 0.0 110.301 -169.132 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 11.8 t -69.52 -53.29 25.52 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 CA-C-N 114.413 -1.267 . . . . 0.0 108.823 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 5.0 m -61.88 -38.9 81.71 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 CA-C-O 119.297 -0.382 . . . . 0.0 110.248 -178.012 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' CYS . . . . . 0.474 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 10.2 t -66.27 -38.31 87.51 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.915 0.886 . . . . 0.0 109.799 176.935 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.4 m -65.24 -21.07 66.69 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 118.803 -0.618 . . . . 0.0 111.309 173.339 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -79.01 -25.97 58.95 Favored Glycine 0 C--N 1.343 0.958 0 CA-C-O 122.173 0.874 . . . . 0.0 112.34 168.745 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.492 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -80.41 -44.85 18.65 Favored 'General case' 0 N--CA 1.429 -1.503 0 N-CA-C 114.85 1.426 . . . . 0.0 114.85 -165.642 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 . . . . . 0 C--N 1.319 -0.744 0 O-C-N 123.546 0.528 . . . . 0.0 110.425 173.865 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 27.2 t0 . . . . . 0 N--CA 1.444 -0.744 0 CA-C-O 118.127 -0.94 . . . . 0.0 109.245 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -55.94 -29.44 73.23 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 123.68 2.92 . . . . 0.0 113.572 -176.535 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 99.1 m -102.27 -8.78 20.97 Favored 'General case' 0 N--CA 1.438 -1.057 0 C-N-CA 125.857 1.663 . . . . 0.0 113.974 -168.408 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.1 tt0 -62.96 -26.0 68.63 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 123.454 0.702 . . . . 0.0 111.327 -179.212 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.9 tmtt? -61.34 -53.23 59.34 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.45 1.1 . . . . 0.0 109.977 169.592 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -63.61 -43.96 95.38 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.714 0.806 . . . . 0.0 109.866 -178.749 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -51.05 -42.03 60.26 Favored 'General case' 0 C--N 1.341 0.217 0 C-N-CA 125.227 1.411 . . . . 0.0 112.773 169.413 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 79.7 m -63.23 -43.53 97.82 Favored 'General case' 0 C--O 1.234 0.239 0 O-C-N 123.166 0.291 . . . . 0.0 111.114 174.577 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 57.1 mm-40 -59.52 -32.93 70.75 Favored 'General case' 0 C--N 1.342 0.28 0 CA-C-O 118.325 -0.845 . . . . 0.0 111.529 177.421 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.626 HD13 HG22 ' A' ' 31' ' ' VAL . 10.6 mm -58.42 -44.63 89.12 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.143 0 CA-C-N 119.519 1.054 . . . . 0.0 110.561 174.868 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 63.8 mm-40 -64.68 -51.13 64.11 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 -169.468 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.0 tmtt? -67.52 -39.54 85.1 Favored 'General case' 0 N--CA 1.442 -0.862 0 C-N-CA 127.536 2.334 . . . . 0.0 111.407 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 15.3 t -52.37 -44.97 65.58 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 170.151 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.8 -44.88 93.74 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-O 118.826 -0.607 . . . . 0.0 109.951 -178.859 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.416 ' HA ' ' CE1' ' A' ' 23' ' ' TYR . 4.9 mm-40 -65.44 -41.34 93.58 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 119.243 0.928 . . . . 0.0 110.65 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.75 -11.87 14.21 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.069 0.948 . . . . 0.0 113.102 171.508 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 57.8 m-80 -125.35 10.09 7.95 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.085 1.354 . . . . 0.0 112.142 -176.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 13.1 m 53.43 42.36 32.0 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-O 122.723 1.249 . . . . 0.0 112.003 -178.254 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.416 ' CE1' ' HA ' ' A' ' 19' ' ' GLN 0.259 6.5 m-85 73.34 13.26 4.66 Favored 'General case' 0 N--CA 1.444 -0.749 0 C-N-CA 128.431 2.692 . . . . 0.0 114.486 168.504 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 68.7 mtm -69.86 84.8 0.49 Allowed 'General case' 0 N--CA 1.441 -0.922 0 C-N-CA 124.876 1.27 . . . . 0.0 109.725 169.861 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -53.34 -25.1 13.83 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.828 0.851 . . . . 0.0 111.337 170.662 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.5 m -51.16 -40.47 58.67 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 126.631 1.972 . . . . 0.0 112.587 170.03 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 54.2 mmtt -74.52 -47.9 30.24 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.358 1.063 . . . . 0.0 108.8 175.507 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 82.3 m -71.65 3.21 4.22 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.905 1.282 . . . . 0.0 113.224 -176.776 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 41.3 mm-40 -54.8 -32.9 60.81 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 119.488 1.04 . . . . 0.0 110.151 167.767 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.99 -58.89 6.17 Favored 'General case' 0 C--N 1.345 0.408 0 C-N-CA 124.977 1.311 . . . . 0.0 111.333 175.791 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.626 HG22 HD13 ' A' ' 14' ' ' ILE . 10.6 p -69.85 -32.27 51.27 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 C-N-CA 124.013 0.925 . . . . 0.0 109.761 -174.206 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.416 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 72.4 mt -60.42 -48.28 89.02 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 N-CA-C 107.106 -1.442 . . . . 0.0 107.106 170.156 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.421 ' HA ' ' HG3' ' A' ' 36' ' ' ARG . 1.6 tp-100 -59.26 -20.39 53.84 Favored 'General case' 0 N--CA 1.439 -0.976 0 O-C-N 121.08 -1.013 . . . . 0.0 112.692 175.589 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.3 tp10 -80.36 -34.93 36.13 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 120.366 1.439 . . . . 0.0 111.83 169.559 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.477 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.9 mt -58.82 -27.13 64.8 Favored 'General case' 0 C--N 1.345 0.399 0 CA-C-N 120.298 1.408 . . . . 0.0 109.456 172.742 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.421 ' HG3' ' HA ' ' A' ' 33' ' ' GLN . 18.3 mmt85 -64.17 -52.22 60.02 Favored 'General case' 0 CA--C 1.52 -0.206 0 C-N-CA 123.915 0.886 . . . . 0.0 109.487 176.362 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -67.99 -28.09 67.13 Favored 'General case' 0 C--O 1.235 0.304 0 O-C-N 123.572 0.545 . . . . 0.0 111.036 -177.73 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 49.8 t -68.11 -53.0 28.59 Favored 'General case' 0 N--CA 1.438 -1.041 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 168.19 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 51.8 t -64.12 -50.53 67.9 Favored 'General case' 0 CA--C 1.515 -0.389 0 C-N-CA 124.33 1.052 . . . . 0.0 112.381 -169.332 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.93 0.95 3.81 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.708 0.803 . . . . 0.0 112.613 -173.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.564 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 9.5 tt0 -82.82 -11.17 58.45 Favored 'General case' 0 N--CA 1.439 -1.008 0 C-N-CA 126.721 2.008 . . . . 0.0 110.855 176.913 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.564 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 77.1 m-85 -139.92 162.02 52.79 Favored Pre-proline 0 N--CA 1.445 -0.677 0 C-N-CA 125.125 1.37 . . . . 0.0 111.877 -168.093 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.43 144.77 46.22 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 N-CA-C 107.692 -1.696 . . . . 0.0 107.692 166.148 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 55.3 tttp -52.23 -40.73 62.02 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 114.189 1.181 . . . . 0.0 114.189 -170.979 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -64.92 -7.63 30.81 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 124.016 0.817 . . . . 0.0 113.604 -179.114 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.3 tpm_? -70.33 -21.16 62.94 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 118.957 1.379 . . . . 0.0 111.61 172.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.8 t -150.69 135.18 17.17 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-O 122.982 1.372 . . . . 0.0 112.867 -169.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 13.4 t -67.43 -52.57 40.4 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 CA-C-N 113.39 -1.732 . . . . 0.0 108.449 175.831 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 3.1 m -64.28 -41.82 93.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 CA-C-O 118.321 -0.847 . . . . 0.0 109.923 -176.412 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' CYS . . . . . 0.42 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 43.9 t -64.53 -30.51 71.53 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.708 1.603 . . . . 0.0 110.019 177.219 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 48.9 m -67.01 -32.37 73.56 Favored 'General case' 0 CA--C 1.536 0.41 0 O-C-N 121.682 -0.636 . . . . 0.0 110.903 170.404 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.51 -33.36 84.44 Favored Glycine 0 C--N 1.344 0.985 0 CA-C-O 123.033 1.352 . . . . 0.0 111.397 168.193 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.477 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.7 OUTLIER -81.03 -45.35 16.69 Favored 'General case' 0 N--CA 1.423 -1.812 0 N-CA-C 115.785 1.772 . . . . 0.0 115.785 -165.695 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 . . . . . 0 CA--C 1.541 0.634 0 CA-C-O 119.121 -0.466 . . . . 0.0 110.219 169.911 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 41.9 t0 . . . . . 0 N--CA 1.449 -0.497 0 CA-C-O 118.33 -0.843 . . . . 0.0 108.895 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -56.68 -35.75 97.75 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 123.626 2.884 . . . . 0.0 112.211 -173.777 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 95.0 m -92.89 -7.96 44.7 Favored 'General case' 0 N--CA 1.442 -0.843 0 C-N-CA 126.246 1.818 . . . . 0.0 113.49 -168.802 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.6 tp60 -61.66 -24.78 66.96 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 117.966 0.348 . . . . 0.0 110.592 179.036 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 61.1 tttm -56.98 -60.01 4.21 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 125.209 1.404 . . . . 0.0 109.758 167.63 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 19.8 mp0 -57.81 -45.6 85.86 Favored 'General case' 0 C--O 1.225 -0.204 0 C-N-CA 123.88 0.872 . . . . 0.0 110.206 -176.851 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -52.54 -41.82 63.84 Favored 'General case' 0 C--N 1.338 0.096 0 C-N-CA 125.055 1.342 . . . . 0.0 112.697 173.392 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 92.4 m -61.69 -47.51 84.98 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 117.706 0.23 . . . . 0.0 110.609 172.504 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -62.21 -24.51 67.26 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-O 117.8 -1.095 . . . . 0.0 112.262 -179.102 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 35.8 mm -56.05 -53.4 39.12 Favored 'Isoleucine or valine' 0 C--N 1.343 0.29 0 CA-C-N 120.126 1.33 . . . . 0.0 109.624 172.556 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -58.73 -54.35 48.03 Favored 'General case' 0 N--CA 1.445 -0.68 0 O-C-N 124.025 0.828 . . . . 0.0 109.196 -179.484 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -66.7 -31.98 73.0 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 119.132 -1.027 . . . . 0.0 111.675 -174.687 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 20.4 t -56.48 -48.74 76.48 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 119.362 0.983 . . . . 0.0 108.681 169.23 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.05 -46.88 84.65 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 123.178 0.591 . . . . 0.0 110.429 179.461 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -56.98 -46.28 82.35 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.663 0.785 . . . . 0.0 111.258 174.22 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.59 -12.74 55.82 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.127 0.971 . . . . 0.0 113.475 175.482 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.3 m-80 -123.87 8.65 8.75 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.65 1.18 . . . . 0.0 112.149 -173.001 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 58.23 40.27 24.94 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 122.376 1.084 . . . . 0.0 110.873 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.262 7.1 m-85 71.97 14.08 5.87 Favored 'General case' 0 N--CA 1.444 -0.764 0 C-N-CA 127.876 2.47 . . . . 0.0 114.66 168.8 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 65.8 mtm -69.62 86.26 0.47 Allowed 'General case' 0 N--CA 1.443 -0.823 0 C-N-CA 125.147 1.379 . . . . 0.0 109.982 169.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -53.37 -25.87 17.14 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.414 0.686 . . . . 0.0 111.4 169.833 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.9 m -53.4 -38.66 63.63 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.834 2.054 . . . . 0.0 112.709 171.139 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.6 mmtm -73.98 -47.95 33.69 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 124.224 1.01 . . . . 0.0 108.58 173.361 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.2 m -73.09 2.7 6.6 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 124.753 1.221 . . . . 0.0 113.567 -173.805 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 27.1 mm-40 -54.49 -28.44 44.82 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 119.604 1.093 . . . . 0.0 110.08 167.268 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.73 -58.44 8.57 Favored 'General case' 0 C--N 1.348 0.504 0 C-N-CA 126.087 1.755 . . . . 0.0 111.955 172.585 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.6 p -72.59 -30.28 33.4 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 C-N-CA 123.873 0.869 . . . . 0.0 110.074 -174.002 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.512 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 75.9 mt -59.18 -48.76 85.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 N-CA-C 106.229 -1.767 . . . . 0.0 106.229 168.675 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.1 -25.8 59.38 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 121.014 -1.054 . . . . 0.0 113.454 174.048 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 49.6 tt0 -75.08 -39.78 60.55 Favored 'General case' 0 N--CA 1.434 -1.249 0 C-N-CA 119.353 -0.939 . . . . 0.0 110.486 174.494 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.463 ' HB3' ' CE2' ' A' ' 53' ' ' PHE . 3.4 mt -57.95 -31.92 67.31 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-O 117.863 -1.065 . . . . 0.0 109.304 169.474 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 19.1 mmt85 -66.19 -56.9 9.06 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 120.143 1.338 . . . . 0.0 109.145 -178.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 12.3 ptmm? -67.94 -22.19 65.06 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.651 -176.901 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.4 t -73.16 -51.92 16.07 Favored 'General case' 0 N--CA 1.439 -1.013 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 166.852 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 43.1 t -60.82 -52.27 65.79 Favored 'General case' 0 CA--C 1.514 -0.442 0 C-N-CA 124.404 1.082 . . . . 0.0 112.16 -170.722 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.16 1.67 4.5 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.382 -0.826 . . . . 0.0 112.554 -173.778 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.555 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 11.6 tt0 -85.29 -11.7 54.12 Favored 'General case' 0 N--CA 1.44 -0.944 0 C-N-CA 126.451 1.9 . . . . 0.0 111.168 -179.127 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.555 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 73.8 m-85 -135.37 160.48 67.8 Favored Pre-proline 0 N--CA 1.447 -0.623 0 C-N-CA 124.907 1.283 . . . . 0.0 111.168 -168.863 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -65.07 120.38 7.6 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 N-CA-C 105.416 -2.571 . . . . 0.0 105.416 165.576 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -43.79 -40.05 4.15 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 115.158 1.54 . . . . 0.0 115.158 -167.5 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.58 -9.71 14.18 Favored Glycine 0 CA--C 1.533 1.202 0 C-N-CA 124.845 1.212 . . . . 0.0 114.048 178.827 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.43 -26.65 68.83 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 119.06 1.43 . . . . 0.0 111.478 169.517 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 11.1 t -140.23 132.12 27.63 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-O 123.235 1.493 . . . . 0.0 112.727 -169.066 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 19.1 t -68.52 -52.06 40.25 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.655 0 CA-C-N 112.762 -2.017 . . . . 0.0 108.365 175.422 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 12.4 m -62.86 -41.86 94.23 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 CA-C-O 118.363 -0.827 . . . . 0.0 110.313 -176.948 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 29.3 t -63.66 -34.11 77.12 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.669 1.588 . . . . 0.0 110.183 176.161 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.9 m -67.65 -28.72 67.96 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 122.854 0.462 . . . . 0.0 110.708 171.772 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -67.89 -34.03 81.29 Favored Glycine 0 C--N 1.346 1.107 0 CA-C-O 123.15 1.417 . . . . 0.0 111.315 167.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.512 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 0.6 OUTLIER -80.38 -44.34 19.56 Favored 'General case' 0 N--CA 1.421 -1.914 0 N-CA-C 115.877 1.806 . . . . 0.0 115.877 -165.64 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 . . . . . 0 C--N 1.322 -0.611 0 CA-C-O 118.779 -0.629 . . . . 0.0 110.393 170.882 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.2 t0 . . . . . 0 N--CA 1.448 -0.566 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -55.45 -33.53 86.26 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 124.204 3.269 . . . . 0.0 112.821 -175.431 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 63.1 m -94.61 -10.41 32.04 Favored 'General case' 0 N--CA 1.438 -1.068 0 C-N-CA 125.599 1.56 . . . . 0.0 113.19 -169.763 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 26.5 tp60 -62.6 -24.94 67.83 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 118.806 0.73 . . . . 0.0 111.161 -179.415 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -60.1 -54.38 46.58 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.434 1.094 . . . . 0.0 109.988 168.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -63.64 -38.83 92.62 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.655 0.782 . . . . 0.0 110.242 -177.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.14 -43.46 70.55 Favored 'General case' 0 C--N 1.341 0.197 0 C-N-CA 124.98 1.312 . . . . 0.0 112.645 169.817 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 77.8 m -57.56 -44.71 85.48 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 121.228 -0.189 . . . . 0.0 110.731 173.259 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -62.01 -25.81 67.87 Favored 'General case' 0 C--O 1.226 -0.137 0 CA-C-O 117.779 -1.105 . . . . 0.0 112.14 178.777 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 22.9 mm -59.38 -54.18 37.94 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.288 0 CA-C-N 120.251 1.387 . . . . 0.0 109.393 173.662 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -59.47 -53.45 58.05 Favored 'General case' 0 N--CA 1.445 -0.708 0 O-C-N 123.991 0.807 . . . . 0.0 109.014 -178.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.47 -31.99 72.52 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 118.987 -1.085 . . . . 0.0 111.664 -175.585 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.0 t -55.82 -48.03 76.16 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 119.42 1.009 . . . . 0.0 108.728 168.824 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.14 -47.24 83.93 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 123.279 0.632 . . . . 0.0 110.277 179.123 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -56.92 -46.25 82.12 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.45 0.7 . . . . 0.0 111.3 174.325 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.4 -13.97 59.86 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.017 0.927 . . . . 0.0 113.301 175.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.4 m-80 -124.13 10.32 8.73 Favored 'General case' 0 C--N 1.342 0.278 0 C-N-CA 124.458 1.103 . . . . 0.0 112.121 -173.07 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 14.8 m 58.22 39.99 25.24 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 119.825 1.193 . . . . 0.0 111.129 178.787 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.275 6.9 m-85 73.27 14.76 4.47 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 127.902 2.481 . . . . 0.0 114.774 168.635 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 50.6 mtm -66.57 85.15 0.11 Allowed 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 125.677 1.591 . . . . 0.0 110.251 169.397 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -56.95 -18.18 12.48 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.609 1.164 . . . . 0.0 112.157 170.124 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.4 p -61.5 -58.27 8.83 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 127.138 2.175 . . . . 0.0 110.797 167.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.5 mmtp -54.43 -41.0 68.88 Favored 'General case' 0 C--N 1.339 0.121 0 C-N-CA 123.392 0.677 . . . . 0.0 109.415 173.329 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.3 m -80.65 7.12 10.84 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -176.913 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 79.6 mm-40 -59.35 -27.42 65.92 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.833 1.197 . . . . 0.0 110.841 167.503 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.22 -54.3 48.41 Favored 'General case' 0 C--N 1.345 0.379 0 C-N-CA 125.513 1.525 . . . . 0.0 111.63 173.089 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.2 p -76.58 -28.74 17.88 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.811 0 C-N-CA 123.69 0.796 . . . . 0.0 109.838 -175.256 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 22.4 mt -59.74 -46.41 93.53 Favored 'Isoleucine or valine' 0 C--N 1.344 0.335 0 N-CA-C 107.034 -1.469 . . . . 0.0 107.034 167.788 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.34 -30.33 51.1 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 123.166 0.586 . . . . 0.0 112.358 173.831 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -78.18 -39.73 39.88 Favored 'General case' 0 N--CA 1.429 -1.518 0 C-N-CA 120.232 -0.587 . . . . 0.0 111.633 177.515 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.414 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.9 mt -63.65 -33.02 74.7 Favored 'General case' 0 C--N 1.343 0.315 0 CA-C-N 119.559 1.072 . . . . 0.0 110.362 172.272 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.12 -61.92 2.2 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.942 1.297 . . . . 0.0 109.406 175.734 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.9 ptmt -65.92 -29.76 70.23 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 114.51 -1.223 . . . . 0.0 110.888 -174.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 52.1 t -62.56 -51.21 68.27 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 168.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.6 t -60.54 -46.75 89.03 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.324 0.65 . . . . 0.0 111.309 -173.43 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.73 -1.94 4.42 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 125.097 1.359 . . . . 0.0 113.247 -179.3 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.55 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 21.0 tt0 -80.18 -10.87 59.78 Favored 'General case' 0 N--CA 1.44 -0.969 0 C-N-CA 123.969 0.907 . . . . 0.0 110.591 172.293 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.55 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 68.3 m-85 -139.37 161.06 59.25 Favored Pre-proline 0 N--CA 1.447 -0.613 0 C-N-CA 124.556 1.143 . . . . 0.0 112.476 -168.454 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -68.21 123.49 10.65 Favored 'Trans proline' 0 N--CA 1.457 -0.675 0 N-CA-C 104.814 -2.802 . . . . 0.0 104.814 164.095 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.0 ptmt -48.97 -33.63 11.37 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 116.5 2.037 . . . . 0.0 116.5 -166.219 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.85 -15.05 40.28 Favored Glycine 0 CA--C 1.532 1.134 0 CA-C-N 118.899 0.772 . . . . 0.0 113.806 178.282 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.8 tpm_? -64.58 -12.95 50.44 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 125.223 1.409 . . . . 0.0 112.457 171.359 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.9 t -149.93 141.09 23.07 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 122.478 1.132 . . . . 0.0 111.756 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.5 t -71.8 -54.12 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 CA-C-N 114.571 -1.195 . . . . 0.0 108.913 178.116 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 6.8 m -59.52 -39.46 79.38 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 122.63 0.372 . . . . 0.0 110.085 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' CYS . . . . . 0.493 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 12.2 t -67.54 -37.23 82.4 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.686 1.195 . . . . 0.0 110.176 177.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 54.1 m -63.7 -27.83 69.48 Favored 'General case' 0 N--CA 1.453 -0.32 0 O-C-N 121.883 -0.511 . . . . 0.0 110.87 172.509 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.29 -25.47 72.96 Favored Glycine 0 C--N 1.343 0.958 0 CA-C-O 122.025 0.791 . . . . 0.0 112.195 170.492 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.493 ' HB2' ' HA ' ' A' ' 50' ' ' CYS . 0.2 OUTLIER -82.35 -49.45 10.01 Favored 'General case' 0 N--CA 1.433 -1.309 0 C-N-CA 126.087 1.755 . . . . 0.0 115.12 -167.72 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 . . . . . 0 C--N 1.32 -0.676 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.105 172.787 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.8 t0 . . . . . 0 N--CA 1.447 -0.586 0 N-CA-C 106.369 -1.715 . . . . 0.0 106.369 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -56.01 -37.04 96.75 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 123.536 2.824 . . . . 0.0 112.362 -169.39 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 67.5 m -92.92 -8.86 42.03 Favored 'General case' 0 N--CA 1.438 -1.053 0 C-N-CA 125.707 1.603 . . . . 0.0 113.396 -168.699 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 28.8 tp60 -62.27 -25.05 67.63 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 118.321 0.509 . . . . 0.0 110.51 178.328 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.3 tmtm? -58.27 -56.93 15.69 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.387 1.075 . . . . 0.0 109.446 168.435 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 21.1 mp0 -61.96 -39.13 91.07 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.037 0.935 . . . . 0.0 110.749 -177.98 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -55.27 -44.83 76.0 Favored 'General case' 0 C--N 1.338 0.108 0 C-N-CA 124.319 1.048 . . . . 0.0 112.203 170.413 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.4 m -59.02 -41.65 88.28 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 121.06 -0.256 . . . . 0.0 111.078 172.329 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -64.26 -21.96 66.78 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-O 117.432 -1.27 . . . . 0.0 112.941 176.744 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.421 HD13 HG13 ' A' ' 31' ' ' VAL . 44.3 mm -59.64 -51.1 76.74 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-N 121.029 1.74 . . . . 0.0 109.34 172.593 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 8.4 mm-40 -61.14 -55.89 27.19 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 108.274 -1.009 . . . . 0.0 108.274 178.605 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 17.7 mtpp -66.2 -27.84 68.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 118.405 -0.807 . . . . 0.0 111.481 -172.082 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.404 ' CB ' HG11 ' A' ' 31' ' ' VAL . 15.7 t -56.71 -51.36 69.1 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 119.14 0.882 . . . . 0.0 109.034 168.837 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.416 HD12 ' SG ' ' A' ' 28' ' ' CYS . 0.2 OUTLIER -56.05 -46.71 78.83 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 123.524 0.729 . . . . 0.0 110.723 178.061 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.458 ' HA ' ' CE1' ' A' ' 23' ' ' TYR . 1.5 mp0 -56.86 -44.49 82.23 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 122.908 0.483 . . . . 0.0 111.635 174.883 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.18 -14.38 61.79 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 177.061 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -120.89 14.19 11.55 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.362 1.065 . . . . 0.0 113.248 -168.665 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 17.2 m 60.98 35.98 18.81 Favored 'General case' 0 C--N 1.346 0.442 0 CA-C-N 120.55 1.523 . . . . 0.0 110.035 -178.244 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.458 ' CE1' ' HA ' ' A' ' 19' ' ' GLN . 45.4 m-85 66.63 16.68 10.46 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 126.516 1.926 . . . . 0.0 113.597 168.555 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 58.0 mtm -72.27 88.04 1.14 Allowed 'General case' 0 N--CA 1.438 -1.039 0 C-N-CA 126.36 1.864 . . . . 0.0 108.808 173.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -52.85 -27.97 20.78 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.016 0.927 . . . . 0.0 110.532 170.577 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.0 m -57.22 -35.94 70.28 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 127.184 2.194 . . . . 0.0 113.325 171.274 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.5 mmtm -72.82 -43.5 62.6 Favored 'General case' 0 C--O 1.233 0.214 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 170.595 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.416 ' SG ' HD12 ' A' ' 18' ' ' LEU 0.25 74.7 m -73.42 1.42 9.77 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 123.875 0.87 . . . . 0.0 113.116 -170.495 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.418 ' HA ' HD12 ' A' ' 32' ' ' ILE . 61.6 mm-40 -55.56 -31.87 62.53 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.319 -0.863 . . . . 0.0 109.919 165.718 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.97 -53.48 57.78 Favored 'General case' 0 C--N 1.346 0.423 0 C-N-CA 124.531 1.132 . . . . 0.0 111.684 173.326 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.421 HG13 HD13 ' A' ' 14' ' ' ILE . 7.5 p -75.97 -24.47 16.6 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 C-N-CA 122.863 0.465 . . . . 0.0 110.245 -174.841 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.506 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 40.3 mt -62.53 -49.38 84.05 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 N-CA-C 106.561 -1.644 . . . . 0.0 106.561 167.88 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -55.92 -29.9 60.8 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 118.94 0.791 . . . . 0.0 111.142 174.829 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -71.42 -44.19 65.34 Favored 'General case' 0 N--CA 1.446 -0.628 0 O-C-N 121.313 -0.867 . . . . 0.0 112.288 175.16 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.495 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.3 mt -59.77 -33.44 71.7 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-N 119.038 0.835 . . . . 0.0 109.777 172.132 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.6 ttt-85 -62.21 -57.01 13.04 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 126.052 1.741 . . . . 0.0 110.629 178.096 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -62.9 -35.64 80.71 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 124.486 1.114 . . . . 0.0 110.872 -179.604 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.3 t -62.38 -50.27 72.24 Favored 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 169.561 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 52.6 t -63.94 -48.93 74.59 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 123.2 0.6 . . . . 0.0 111.724 -170.348 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.4 -0.65 5.14 Favored 'General case' 0 N--CA 1.444 -0.737 0 C-N-CA 124.575 1.15 . . . . 0.0 112.091 -177.942 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.471 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 2.1 tp-100 -80.06 -7.49 58.89 Favored 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 123.797 0.839 . . . . 0.0 110.963 173.475 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.471 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 73.3 m-85 -143.28 161.36 48.1 Favored Pre-proline 0 N--CA 1.444 -0.749 0 C-N-CA 124.286 1.035 . . . . 0.0 112.472 -168.74 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -69.24 110.15 2.38 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 N-CA-C 105.284 -2.622 . . . . 0.0 105.284 164.815 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -43.52 -30.49 0.58 Allowed 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 117.937 2.569 . . . . 0.0 117.937 -166.584 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -55.39 -16.44 9.98 Favored Glycine 0 CA--C 1.538 1.5 0 CA-C-N 119.559 1.072 . . . . 0.0 114.071 172.622 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 12.7 tpt180 -54.12 -28.22 38.22 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 127.062 2.145 . . . . 0.0 111.789 168.432 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.2 t -146.63 140.89 26.35 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-O 122.483 1.135 . . . . 0.0 112.36 -169.647 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 11.7 t -69.26 -55.66 14.54 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-N 114.107 -1.406 . . . . 0.0 108.941 178.079 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 7.6 m -59.21 -41.72 84.73 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 122.897 0.479 . . . . 0.0 109.915 -177.759 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' CYS . . . . . 0.49 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 14.0 t -67.33 -35.55 79.64 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.967 1.307 . . . . 0.0 110.044 179.211 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 54.7 m -65.95 -23.63 66.64 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 118.734 -0.651 . . . . 0.0 111.156 172.506 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -77.12 -26.91 61.0 Favored Glycine 0 C--N 1.345 1.04 0 CA-C-O 122.423 1.013 . . . . 0.0 111.832 168.605 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.506 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 0.4 OUTLIER -80.15 -41.54 25.18 Favored 'General case' 0 N--CA 1.42 -1.958 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 -166.8 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 . . . . . 0 C--N 1.322 -0.621 0 O-C-N 123.883 0.739 . . . . 0.0 111.164 177.975 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.2 t0 . . . . . 0 CA--C 1.539 0.533 0 N-CA-C 106.148 -1.797 . . . . 0.0 106.148 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo -62.04 -30.67 83.24 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 124.318 3.345 . . . . 0.0 112.685 -172.131 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 89.9 m -93.29 -14.17 27.3 Favored 'General case' 0 N--CA 1.437 -1.076 0 C-N-CA 124.863 1.265 . . . . 0.0 112.299 -168.456 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 21.4 tp60 -60.48 -25.53 66.12 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 123.432 0.693 . . . . 0.0 110.739 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 65.9 tttp -62.08 -56.85 14.71 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 124.14 0.976 . . . . 0.0 110.162 168.533 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -61.15 -37.7 83.79 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.788 0.835 . . . . 0.0 110.481 -176.355 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.49 -43.64 71.96 Favored 'General case' 0 CA--C 1.52 -0.195 0 C-N-CA 125.186 1.394 . . . . 0.0 112.826 169.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.8 m -58.75 -43.86 90.39 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 121.028 0.442 . . . . 0.0 110.817 173.092 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 40.2 mm-40 -64.27 -21.1 66.47 Favored 'General case' 0 N--CA 1.456 -0.151 0 CA-C-O 117.735 -1.126 . . . . 0.0 112.387 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.402 HD13 HG13 ' A' ' 31' ' ' VAL . 36.8 mm -60.12 -52.62 59.1 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 CA-C-N 120.574 1.534 . . . . 0.0 109.363 171.753 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -58.27 -55.52 33.96 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 107.624 -1.251 . . . . 0.0 107.624 -179.231 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 41.1 mtpt -70.02 -29.44 66.5 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 118.201 -0.904 . . . . 0.0 111.64 -170.449 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.411 ' CB ' HG11 ' A' ' 31' ' ' VAL . 16.8 t -56.87 -47.05 81.36 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 168.57 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.15 -45.45 90.93 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 118.377 -0.82 . . . . 0.0 110.133 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -58.47 -46.53 86.42 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 119.428 1.013 . . . . 0.0 111.222 174.228 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.05 -14.57 55.41 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.811 0.844 . . . . 0.0 113.24 176.118 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -122.56 9.16 9.58 Favored 'General case' 0 C--N 1.342 0.256 0 C-N-CA 124.228 1.011 . . . . 0.0 112.231 -173.604 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.6 m 58.25 40.23 24.91 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 122.601 1.191 . . . . 0.0 110.776 179.1 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.26 7.1 m-85 72.14 15.1 5.53 Favored 'General case' 0 N--CA 1.443 -0.812 0 C-N-CA 127.914 2.485 . . . . 0.0 114.316 169.075 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 67.3 mtm -70.44 86.82 0.62 Allowed 'General case' 0 N--CA 1.441 -0.915 0 C-N-CA 125.5 1.52 . . . . 0.0 110.047 169.715 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -55.05 -23.47 20.19 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 125.769 1.628 . . . . 0.0 110.569 168.183 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -55.26 -41.53 72.31 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.864 1.665 . . . . 0.0 112.004 169.576 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 50.6 mmtt -73.7 -45.68 50.83 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.991 0.916 . . . . 0.0 108.555 175.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.1 m -73.68 1.6 9.92 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -172.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 65.4 mm-40 -51.81 -34.57 40.72 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 119.105 0.866 . . . . 0.0 109.986 166.509 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.68 -57.4 12.9 Favored 'General case' 0 C--N 1.346 0.425 0 C-N-CA 125.757 1.623 . . . . 0.0 111.447 175.087 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.411 HG11 ' CB ' ' A' ' 17' ' ' CYS . 8.7 p -72.44 -29.79 32.45 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.645 0 C-N-CA 123.618 0.767 . . . . 0.0 110.194 -173.844 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.44 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 56.2 mt -59.97 -50.66 79.27 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 N-CA-C 106.129 -1.804 . . . . 0.0 106.129 168.621 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.417 HE22 ' NH1' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -56.91 -28.84 62.47 Favored 'General case' 0 N--CA 1.448 -0.574 0 O-C-N 121.635 -0.666 . . . . 0.0 112.77 175.306 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -74.99 -37.94 61.74 Favored 'General case' 0 N--CA 1.432 -1.361 0 CA-C-N 118.585 0.63 . . . . 0.0 111.39 177.155 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.416 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.4 mt -59.27 -34.11 71.86 Favored 'General case' 0 C--N 1.346 0.418 0 CA-C-N 119.502 1.046 . . . . 0.0 109.872 169.916 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.417 ' NH1' HE22 ' A' ' 33' ' ' GLN . 0.8 OUTLIER -67.13 -55.62 13.43 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.214 1.406 . . . . 0.0 111.732 179.722 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 57.4 mttm -62.09 -33.31 74.19 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 124.822 1.249 . . . . 0.0 110.326 178.345 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.3 t -64.2 -52.76 57.29 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 168.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.4 t -57.7 -50.31 73.63 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 123.762 0.825 . . . . 0.0 112.079 -172.368 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.79 -0.87 7.84 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 114.961 -1.018 . . . . 0.0 112.444 -175.739 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.468 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 2.7 tp-100 -85.38 -6.57 59.21 Favored 'General case' 0 N--CA 1.437 -1.111 0 C-N-CA 124.345 1.058 . . . . 0.0 111.548 179.408 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.468 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 77.9 m-85 -140.26 160.23 60.68 Favored Pre-proline 0 N--CA 1.445 -0.685 0 C-N-CA 124.472 1.109 . . . . 0.0 111.609 -168.7 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -67.37 118.17 5.38 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 N-CA-C 106.408 -2.189 . . . . 0.0 106.408 166.55 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 62.1 tttm -41.27 -38.15 1.1 Allowed 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 117.024 2.231 . . . . 0.0 117.024 -168.019 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.28 -13.62 16.28 Favored Glycine 0 CA--C 1.537 1.418 0 C-N-CA 123.997 0.808 . . . . 0.0 114.066 176.206 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.77 -31.12 64.3 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 126.381 1.872 . . . . 0.0 112.057 169.495 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.5 t -146.01 136.97 24.5 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-O 123.113 1.435 . . . . 0.0 113.798 -168.028 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.1 t -71.89 -54.57 16.37 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.735 0 CA-C-N 112.726 -2.034 . . . . 0.0 108.833 177.824 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 17.7 m -60.19 -39.36 80.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 C-N-CA 123.004 0.522 . . . . 0.0 110.558 -178.643 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' CYS . . . . . 0.448 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 6.3 t -66.54 -38.9 88.13 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.102 1.361 . . . . 0.0 109.954 176.328 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 51.2 m -64.88 -26.64 68.41 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-O 119.231 -0.414 . . . . 0.0 110.822 172.852 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.34 -26.47 71.92 Favored Glycine 0 C--N 1.342 0.915 0 CA-C-N 118.088 0.404 . . . . 0.0 112.291 169.38 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.448 ' HB2' ' HA ' ' A' ' 50' ' ' CYS . 0.3 OUTLIER -81.2 -48.11 12.52 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 115.893 1.812 . . . . 0.0 115.893 -165.737 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 . . . . . 0 C--N 1.32 -0.678 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.243 173.5 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.9 t0 . . . . . 0 N--CA 1.442 -0.827 0 N-CA-C 105.964 -1.865 . . . . 0.0 105.964 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -53.56 -31.51 59.59 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 124.363 3.375 . . . . 0.0 112.868 -169.838 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.409 ' HB3' ' CD2' ' A' ' 35' ' ' LEU . 73.0 m -94.26 -13.69 26.27 Favored 'General case' 0 N--CA 1.428 -1.553 0 C-N-CA 126.384 1.874 . . . . 0.0 112.735 -170.414 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 32.3 tp60 -63.11 -25.58 68.43 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 118.898 0.772 . . . . 0.0 110.767 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -60.37 -53.62 55.45 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.979 0.912 . . . . 0.0 110.191 169.399 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -64.86 -38.97 92.74 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.249 0.62 . . . . 0.0 110.155 -178.162 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.07 -45.33 71.7 Favored 'General case' 0 C--N 1.341 0.216 0 C-N-CA 125.186 1.394 . . . . 0.0 112.061 169.537 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 89.1 m -57.33 -43.05 83.05 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 117.632 0.196 . . . . 0.0 110.473 173.813 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -65.06 -25.29 67.75 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-O 117.547 -1.216 . . . . 0.0 113.053 176.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 30.2 mm -58.71 -52.01 65.1 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 CA-C-N 120.677 1.581 . . . . 0.0 108.961 171.043 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -60.8 -53.5 56.65 Favored 'General case' 0 N--CA 1.442 -0.862 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 -175.7 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 16.2 mtpp -69.28 -31.1 69.38 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 118.215 -0.898 . . . . 0.0 111.849 -174.707 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.9 t -56.87 -45.9 82.18 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 169.026 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.6 -45.26 92.44 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-O 118.481 -0.771 . . . . 0.0 110.467 179.162 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -58.43 -44.81 89.26 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 119.219 0.918 . . . . 0.0 111.314 173.597 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.24 -13.46 58.38 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 113.345 0.869 . . . . 0.0 113.345 175.475 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 -124.82 9.35 8.22 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 124.483 1.113 . . . . 0.0 112.405 -172.759 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.3 m 58.04 40.12 25.69 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 122.318 1.056 . . . . 0.0 110.862 179.235 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.258 6.7 m-85 72.23 13.35 5.71 Favored 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 127.854 2.462 . . . . 0.0 114.661 168.737 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 67.3 mtm -70.78 85.87 0.67 Allowed 'General case' 0 N--CA 1.442 -0.851 0 C-N-CA 125.039 1.336 . . . . 0.0 109.798 170.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -53.58 -25.85 19.08 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.178 0.591 . . . . 0.0 111.45 171.565 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.1 m -51.09 -42.02 60.36 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 126.13 1.772 . . . . 0.0 112.317 170.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 55.1 mmtt -70.89 -47.59 58.34 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 124.188 0.995 . . . . 0.0 108.93 174.415 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.2 m -72.7 2.71 6.07 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 124.662 1.185 . . . . 0.0 113.171 -174.408 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 52.4 mm-40 -56.23 -28.25 57.78 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 119.814 1.188 . . . . 0.0 109.874 166.664 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.97 -56.24 24.33 Favored 'General case' 0 C--N 1.346 0.44 0 C-N-CA 125.313 1.445 . . . . 0.0 111.833 172.329 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.1 p -75.74 -26.02 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.746 0 C-N-CA 123.625 0.77 . . . . 0.0 109.826 -174.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.544 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 57.6 mt -62.75 -44.3 99.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 N-CA-C 107.309 -1.367 . . . . 0.0 107.309 168.517 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.466 HE22 ' NH1' ' A' ' 36' ' ' ARG . 2.9 tp-100 -56.47 -28.33 59.4 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 123.506 0.723 . . . . 0.0 112.379 172.401 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -74.98 -44.02 50.69 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 118.571 0.623 . . . . 0.0 111.854 173.011 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.512 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.6 mt -63.64 -30.89 71.94 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 119.294 0.952 . . . . 0.0 110.901 175.709 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.466 ' NH1' HE22 ' A' ' 33' ' ' GLN . 0.2 OUTLIER -57.26 -59.29 5.34 Favored 'General case' 0 CA--C 1.519 -0.233 0 C-N-CA 124.443 1.097 . . . . 0.0 109.415 173.502 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 48.8 mttp -60.04 -37.7 80.57 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 113.751 -1.568 . . . . 0.0 110.972 -177.295 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 42.5 t -62.2 -52.18 64.84 Favored 'General case' 0 N--CA 1.442 -0.861 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 171.179 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.5 t -61.6 -45.26 94.84 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.532 0.733 . . . . 0.0 111.888 -171.343 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.75 -2.4 11.85 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.095 -0.957 . . . . 0.0 112.883 -177.343 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.469 ' HB3' ' CE1' ' A' ' 42' ' ' TYR . 2.6 tp-100 -86.3 -5.53 59.16 Favored 'General case' 0 N--CA 1.438 -1.027 0 C-N-CA 124.651 1.18 . . . . 0.0 111.565 -178.773 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.469 ' CE1' ' HB3' ' A' ' 41' ' ' GLN . 82.7 m-85 -139.38 160.89 60.03 Favored Pre-proline 0 N--CA 1.445 -0.715 0 C-N-CA 125.13 1.372 . . . . 0.0 110.708 -168.736 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -67.42 111.12 2.22 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 N-CA-C 104.574 -2.895 . . . . 0.0 104.574 165.306 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 36.4 mmtm -39.43 -40.54 0.84 Allowed 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 116.753 2.131 . . . . 0.0 116.753 -165.448 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.5 -11.81 11.28 Favored Glycine 0 CA--C 1.536 1.398 0 C-N-CA 124.679 1.133 . . . . 0.0 114.303 176.259 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 31.9 tpt85 -52.52 -33.83 47.06 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 127.072 2.149 . . . . 0.0 111.675 169.168 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.0 t -140.71 140.75 34.94 Favored 'General case' 0 N--CA 1.44 -0.966 0 CA-C-O 122.424 1.107 . . . . 0.0 111.703 -167.653 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 8.8 t -70.34 -54.27 19.26 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 CA-C-N 113.828 -1.533 . . . . 0.0 108.781 179.078 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 7.0 m -61.48 -38.05 79.19 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-O 119.211 -0.423 . . . . 0.0 110.376 -178.189 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' CYS . . . . . 0.467 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 11.9 t -67.32 -37.73 83.79 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.378 1.071 . . . . 0.0 109.93 176.67 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 45.2 m -64.97 -27.04 68.57 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.817 -0.552 . . . . 0.0 110.649 172.218 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -71.36 -26.84 72.61 Favored Glycine 0 C--N 1.344 0.993 0 CA-C-O 121.74 0.633 . . . . 0.0 112.136 169.485 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.544 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 0.2 OUTLIER -82.04 -48.18 11.73 Favored 'General case' 0 N--CA 1.432 -1.34 0 C-N-CA 126.059 1.744 . . . . 0.0 115.074 -167.153 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 . . . . . 0 CA--C 1.543 0.681 0 CA-C-O 118.732 -0.651 . . . . 0.0 110.794 172.292 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 39.5 t0 . . . . . 0 CA--C 1.541 0.63 0 CA-C-O 118.267 -0.873 . . . . 0.0 109.977 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -55.15 -32.02 78.19 Favored 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 124.37 3.38 . . . . 0.0 113.418 -176.134 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 66.3 m -98.53 -10.98 22.7 Favored 'General case' 0 N--CA 1.437 -1.099 0 C-N-CA 125.929 1.692 . . . . 0.0 113.36 -168.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 20.2 tp60 -64.09 -25.91 68.31 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 118.614 0.643 . . . . 0.0 111.126 -179.104 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -59.34 -55.78 30.43 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.016 0.926 . . . . 0.0 109.54 169.666 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -63.92 -36.05 82.67 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.539 0.735 . . . . 0.0 110.126 -177.406 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -60.46 -39.16 86.57 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 124.047 0.939 . . . . 0.0 112.065 174.095 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 70.9 m -58.18 -44.76 88.19 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 118.494 0.588 . . . . 0.0 110.553 171.82 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 30.4 mm-40 -64.58 -22.68 67.04 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 117.745 -1.122 . . . . 0.0 112.393 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.424 HD13 HG13 ' A' ' 31' ' ' VAL . 43.8 mm -58.55 -55.14 24.65 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.263 0 CA-C-N 120.377 1.444 . . . . 0.0 109.302 171.161 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -60.31 -53.04 62.39 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 -177.522 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 16.0 mtpp -68.12 -30.74 69.97 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 118.264 -0.874 . . . . 0.0 111.495 -174.011 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.8 t -58.49 -47.77 83.01 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 119.412 1.005 . . . . 0.0 108.657 168.808 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.74 -46.96 83.75 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 123.235 0.614 . . . . 0.0 110.178 179.555 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -57.42 -44.67 84.82 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.777 0.831 . . . . 0.0 111.39 173.741 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.72 -13.21 61.06 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 174.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 45.2 m-80 -124.25 8.46 8.51 Favored 'General case' 0 C--N 1.343 0.284 0 C-N-CA 124.515 1.126 . . . . 0.0 112.304 -172.129 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.1 m 59.0 40.31 22.47 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 122.44 1.115 . . . . 0.0 110.807 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.272 7.1 m-85 72.11 14.48 5.66 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 127.697 2.399 . . . . 0.0 114.649 168.636 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 60.7 mtm -69.38 84.64 0.4 Allowed 'General case' 0 N--CA 1.441 -0.875 0 C-N-CA 125.403 1.481 . . . . 0.0 110.218 169.946 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 51.3 tt0 -54.0 -23.18 12.45 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.066 1.347 . . . . 0.0 111.955 169.92 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.7 m -58.61 -47.59 83.84 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 126.114 1.765 . . . . 0.0 111.699 169.458 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.4 mmtm -64.64 -47.95 76.63 Favored 'General case' 0 C--N 1.342 0.244 0 C-N-CA 124.095 0.958 . . . . 0.0 108.897 175.283 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 71.5 m -68.95 2.13 2.9 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 124.601 1.16 . . . . 0.0 113.186 -179.125 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -54.58 -27.62 40.25 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 119.826 1.194 . . . . 0.0 111.598 167.11 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.62 -54.66 43.94 Favored 'General case' 0 C--N 1.344 0.354 0 C-N-CA 124.747 1.219 . . . . 0.0 111.936 172.155 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.424 HG13 HD13 ' A' ' 14' ' ' ILE . 10.0 p -77.62 -30.58 16.93 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.738 0 C-N-CA 123.483 0.713 . . . . 0.0 110.192 -173.664 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.635 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 57.9 mt -63.54 -42.26 95.52 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 169.563 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -53.99 -40.47 66.96 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-N 119.981 1.264 . . . . 0.0 111.547 169.879 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -70.08 -39.82 75.36 Favored 'General case' 0 N--CA 1.435 -1.222 0 C-N-CA 118.975 -1.09 . . . . 0.0 110.345 -178.343 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.503 HD13 ' CD1' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -71.3 -27.68 63.58 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 123.654 0.782 . . . . 0.0 110.046 179.378 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.596 HH11 HG22 ' A' ' 32' ' ' ILE . 0.3 OUTLIER -62.25 -59.09 5.53 Favored 'General case' 0 CA--C 1.519 -0.227 0 C-N-CA 126.616 1.967 . . . . 0.0 107.714 172.053 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 58.0 mttm -59.04 -38.99 80.62 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 114.489 -1.232 . . . . 0.0 110.462 -178.626 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 43.7 t -59.25 -54.23 49.25 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 123.79 0.836 . . . . 0.0 108.955 172.093 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 47.3 t -60.42 -42.58 96.3 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 121.593 0.711 . . . . 0.0 111.922 -173.345 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.44 -3.35 11.04 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.787 1.235 . . . . 0.0 113.466 -179.358 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.563 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 20.7 tt0 -84.39 -9.48 58.38 Favored 'General case' 0 N--CA 1.44 -0.959 0 C-N-CA 124.381 1.073 . . . . 0.0 111.019 178.203 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.563 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 71.6 m-85 -140.37 160.98 57.53 Favored Pre-proline 0 N--CA 1.446 -0.671 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -166.969 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -69.66 125.83 12.66 Favored 'Trans proline' 0 N--CA 1.457 -0.633 0 N-CA-C 105.312 -2.611 . . . . 0.0 105.312 164.399 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 37.8 mmtt -52.91 -31.38 39.56 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 115.362 1.616 . . . . 0.0 115.362 -165.365 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.12 -13.16 26.45 Favored Glycine 0 CA--C 1.535 1.315 0 C-N-CA 124.014 0.816 . . . . 0.0 113.975 175.765 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.595 HH11 ' HG3' ' A' ' 46' ' ' ARG . 3.9 tpm_? -65.48 -15.38 62.59 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.481 1.912 . . . . 0.0 112.748 169.791 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.1 t -153.26 137.57 16.61 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 120.095 1.316 . . . . 0.0 112.612 -173.782 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 20.4 t -68.26 -55.65 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.658 0 CA-C-N 113.784 -1.553 . . . . 0.0 108.813 174.695 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 7.5 m -61.26 -43.65 96.91 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 CA-C-O 118.881 -0.581 . . . . 0.0 110.079 -174.036 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 11.1 t -63.87 -33.55 75.95 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.776 1.631 . . . . 0.0 110.01 178.839 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 61.5 m -67.1 -26.2 66.59 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 119.127 -0.463 . . . . 0.0 111.118 172.395 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.77 -33.4 57.89 Favored Glycine 0 C--N 1.345 1.042 0 CA-C-O 123.313 1.507 . . . . 0.0 111.055 167.727 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.635 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 0.7 OUTLIER -78.23 -41.72 33.4 Favored 'General case' 0 N--CA 1.42 -1.932 0 N-CA-C 116.318 1.969 . . . . 0.0 116.318 -164.82 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 . . . . . 0 C--N 1.321 -0.64 0 CA-C-O 118.483 -0.77 . . . . 0.0 111.675 170.95 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.429 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 40.3 t0 . . . . . 0 CA--C 1.543 0.705 0 CA-C-O 119.244 -0.408 . . . . 0.0 109.938 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.455 ' HD3' ' HE ' ' A' ' 46' ' ' ARG . 23.6 Cg_exo -66.22 -32.04 43.2 Favored 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 125.073 3.849 . . . . 0.0 112.593 -174.499 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.453 ' HB3' ' CD2' ' A' ' 35' ' ' LEU . 99.1 m -93.85 -16.05 24.46 Favored 'General case' 0 N--CA 1.437 -1.075 0 C-N-CA 124.78 1.232 . . . . 0.0 112.562 -167.947 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 20.7 tp60 -59.67 -25.56 64.83 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 123.731 0.812 . . . . 0.0 111.114 177.285 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 51.5 tttm -61.03 -57.27 13.28 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.629 1.172 . . . . 0.0 110.097 168.537 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -61.64 -40.24 94.21 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.687 0.795 . . . . 0.0 110.392 -176.437 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.01 -45.89 52.33 Favored 'General case' 0 C--N 1.341 0.204 0 C-N-CA 125.334 1.454 . . . . 0.0 112.226 169.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 86.4 m -59.54 -45.46 91.72 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.738 -0.21 . . . . 0.0 110.642 175.517 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -60.4 -30.68 69.75 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 118.534 -0.746 . . . . 0.0 111.529 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.1 mt -64.8 -49.56 79.5 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.568 0 CA-C-N 119.451 1.023 . . . . 0.0 110.316 177.362 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.8 mm-40 -54.66 -56.06 23.12 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 124.118 0.886 . . . . 0.0 109.127 176.214 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 7.9 mptt -66.02 -33.29 75.48 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 119.592 -0.843 . . . . 0.0 111.878 -176.369 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 13.1 t -54.11 -49.16 69.77 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-N 119.22 0.918 . . . . 0.0 108.536 168.689 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.55 -47.49 84.06 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 123.878 0.871 . . . . 0.0 110.126 179.022 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -56.23 -46.94 79.33 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.603 0.761 . . . . 0.0 111.223 174.385 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.35 -13.2 60.24 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.1 0.96 . . . . 0.0 113.556 176.091 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -121.68 8.02 10.02 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.674 1.19 . . . . 0.0 111.989 -173.662 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 59.12 40.18 22.18 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 122.392 1.091 . . . . 0.0 110.694 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.265 7.5 m-85 72.05 14.72 5.69 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 127.911 2.485 . . . . 0.0 114.635 168.928 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 63.5 mtm -68.82 85.44 0.32 Allowed 'General case' 0 N--CA 1.44 -0.964 0 C-N-CA 125.086 1.354 . . . . 0.0 110.117 169.721 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -55.54 -19.31 9.53 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.568 1.147 . . . . 0.0 111.456 169.04 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.6 m -59.28 -40.71 86.99 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 127.314 2.246 . . . . 0.0 112.1 169.105 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.2 mmtm -73.33 -47.13 45.05 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 124.409 1.084 . . . . 0.0 108.764 175.155 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 76.3 m -73.53 6.82 2.75 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 125.211 1.404 . . . . 0.0 112.458 -177.659 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 61.5 mm-40 -53.85 -37.42 63.64 Favored 'General case' 0 C--N 1.341 0.206 0 O-C-N 120.858 -1.151 . . . . 0.0 110.601 167.464 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.32 -51.33 69.97 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.919 0.888 . . . . 0.0 111.706 179.132 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 5.8 p -75.69 -26.34 17.99 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.775 0 C-N-CA 123.084 0.554 . . . . 0.0 110.199 -176.719 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.563 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 58.2 mt -62.22 -49.79 82.61 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 167.75 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.468 ' HA ' ' CG ' ' A' ' 36' ' ' ARG . 3.2 tt0 -54.87 -33.26 61.71 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 118.962 0.801 . . . . 0.0 111.66 175.37 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -68.6 -41.81 79.07 Favored 'General case' 0 N--CA 1.441 -0.918 0 CA-C-O 119.024 -0.512 . . . . 0.0 111.87 174.04 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.49 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.6 mt -63.57 -37.1 86.04 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 117.203 -1.38 . . . . 0.0 110.984 173.943 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.468 ' CG ' ' HA ' ' A' ' 33' ' ' GLN . 2.1 ptt180 -69.1 -40.93 78.09 Favored 'General case' 0 C--N 1.344 0.328 0 CA-C-N 120.625 1.557 . . . . 0.0 109.952 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -63.07 -41.48 99.45 Favored 'General case' 0 C--N 1.341 0.235 0 CA-C-O 119.457 -0.306 . . . . 0.0 111.17 175.34 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.1 t -57.42 -51.69 68.39 Favored 'General case' 0 C--O 1.22 -0.483 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 172.186 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.3 t -58.87 -48.3 81.87 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 124.417 1.087 . . . . 0.0 111.879 -172.208 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.78 -1.23 6.61 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.243 -0.89 . . . . 0.0 112.781 -177.229 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.545 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 20.1 tt0 -80.98 -10.96 59.65 Favored 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 124.208 1.003 . . . . 0.0 110.893 175.372 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.545 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 83.6 m-85 -135.07 157.88 76.0 Favored Pre-proline 0 N--CA 1.445 -0.715 0 C-N-CA 125.304 1.442 . . . . 0.0 110.807 -168.578 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -67.57 105.75 1.14 Allowed 'Trans proline' 0 N--CA 1.455 -0.783 0 N-CA-C 104.671 -2.857 . . . . 0.0 104.671 166.324 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 22.5 pttp -39.14 -38.74 0.51 Allowed 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 117.895 2.554 . . . . 0.0 117.895 -164.533 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.02 -15.09 19.69 Favored Glycine 0 CA--C 1.536 1.379 0 CA-C-N 119.365 0.984 . . . . 0.0 114.04 175.77 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.455 ' HE ' ' HD3' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -57.5 -27.44 62.54 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 126.281 1.833 . . . . 0.0 112.853 170.06 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.8 t -134.95 137.44 43.1 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-O 122.663 1.22 . . . . 0.0 110.865 -173.1 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 21.6 t -70.66 -55.9 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 CA-C-N 113.904 -1.498 . . . . 0.0 108.797 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 9.7 m -58.44 -43.02 85.77 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 CA-C-O 119.203 -0.427 . . . . 0.0 110.004 -178.616 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' CYS . . . . . 0.459 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 11.4 t -64.67 -35.67 81.78 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.764 1.625 . . . . 0.0 110.1 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 52.5 m -66.02 -25.5 67.09 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 118.959 -0.543 . . . . 0.0 110.921 172.751 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.42 -40.32 54.92 Favored Glycine 0 C--N 1.344 0.987 0 CA-C-O 123.935 1.853 . . . . 0.0 110.719 167.93 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.563 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 0.5 OUTLIER -69.45 -40.5 77.14 Favored 'General case' 0 N--CA 1.421 -1.924 0 C-N-CA 126.136 1.774 . . . . 0.0 115.564 -166.319 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 . . . . . 0 C--N 1.32 -0.693 0 CA-C-O 118.704 -0.665 . . . . 0.0 111.507 174.501 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.9 t0 . . . . . 0 CA--C 1.536 0.406 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -57.19 -31.06 89.46 Favored 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 124.039 3.159 . . . . 0.0 112.901 -175.363 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 54.7 m -94.27 -10.47 32.76 Favored 'General case' 0 N--CA 1.437 -1.108 0 C-N-CA 125.362 1.465 . . . . 0.0 113.052 -169.833 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 27.7 tp60 -63.21 -24.54 67.92 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 118.447 0.567 . . . . 0.0 111.256 -179.249 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.6 tppt? -60.48 -53.76 53.65 Favored 'General case' 0 C--N 1.339 0.132 0 C-N-CA 122.991 0.517 . . . . 0.0 109.97 169.276 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -62.49 -39.66 94.2 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.551 0.741 . . . . 0.0 110.004 -177.916 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -53.97 -45.9 71.52 Favored 'General case' 0 C--N 1.343 0.308 0 C-N-CA 125.044 1.338 . . . . 0.0 112.34 169.921 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 67.6 m -57.92 -42.76 85.47 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 121.333 -0.147 . . . . 0.0 110.786 174.147 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -65.04 -22.7 67.02 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-O 117.604 -1.189 . . . . 0.0 112.706 178.216 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 27.8 mm -59.41 -52.83 56.25 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.244 0 CA-C-N 120.515 1.507 . . . . 0.0 108.962 172.839 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 33.7 mm-40 -58.34 -53.97 52.24 Favored 'General case' 0 N--CA 1.442 -0.828 0 O-C-N 123.989 0.806 . . . . 0.0 109.051 178.344 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 57.1 mmtt -68.17 -30.93 70.15 Favored 'General case' 0 N--CA 1.457 -0.078 0 C-N-CA 118.507 -1.277 . . . . 0.0 111.555 -173.254 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 19.4 t -56.85 -48.73 77.41 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 168.709 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.93 -46.73 84.59 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 123.203 0.601 . . . . 0.0 110.53 179.353 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -57.16 -45.78 83.32 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.751 0.821 . . . . 0.0 111.231 174.084 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.98 -12.47 55.22 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 175.216 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -124.38 8.56 8.43 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.695 1.198 . . . . 0.0 112.387 -172.684 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 58.49 40.1 24.3 Favored 'General case' 0 C--N 1.345 0.393 0 CA-C-O 122.418 1.104 . . . . 0.0 110.913 179.445 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.259 7.0 m-85 71.88 13.7 6.02 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 127.826 2.45 . . . . 0.0 114.692 168.819 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 66.0 mtm -69.98 85.59 0.52 Allowed 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 125.051 1.34 . . . . 0.0 109.791 170.115 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -54.04 -24.93 18.89 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.283 0.633 . . . . 0.0 111.504 171.201 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.2 m -52.63 -40.33 62.66 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 126.293 1.837 . . . . 0.0 112.297 170.719 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.1 mmtm -71.79 -46.42 58.37 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.212 1.005 . . . . 0.0 108.794 174.218 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.7 m -74.67 5.29 5.03 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 124.749 1.219 . . . . 0.0 113.222 -173.618 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 -57.66 -26.8 62.18 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 119.196 0.907 . . . . 0.0 110.674 166.555 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.55 -55.7 31.18 Favored 'General case' 0 C--N 1.346 0.446 0 C-N-CA 126.21 1.804 . . . . 0.0 111.709 171.806 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.6 p -76.07 -27.02 17.75 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.69 0 C-N-CA 123.693 0.797 . . . . 0.0 109.759 -175.371 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 26.4 mt -62.41 -45.9 97.68 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 168.086 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -52.13 -36.9 52.65 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 118.755 0.707 . . . . 0.0 111.265 171.698 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -71.55 -43.38 66.49 Favored 'General case' 0 N--CA 1.433 -1.311 0 CA-C-O 118.633 -0.699 . . . . 0.0 111.678 178.568 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.496 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.3 mt -63.37 -31.73 72.96 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 119.637 1.108 . . . . 0.0 110.668 173.988 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.456 HH11 ' HG3' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -60.67 -58.47 8.32 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.495 1.118 . . . . 0.0 108.783 177.363 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 55.9 mtpt -62.32 -35.64 79.7 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 113.862 -1.517 . . . . 0.0 111.143 -178.615 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 41.8 t -60.9 -51.83 67.6 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 170.542 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 51.5 t -62.79 -49.16 76.08 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 123.406 0.682 . . . . 0.0 111.647 -170.785 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.05 -1.39 5.79 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.111 -0.95 . . . . 0.0 112.551 -177.035 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.435 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 2.2 tp-100 -84.5 -7.18 59.36 Favored 'General case' 0 N--CA 1.435 -1.194 0 C-N-CA 124.735 1.214 . . . . 0.0 111.476 177.298 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.435 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 72.9 m-85 -139.67 160.72 60.09 Favored Pre-proline 0 N--CA 1.446 -0.644 0 C-N-CA 124.705 1.202 . . . . 0.0 111.23 -169.43 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -67.29 120.14 7.19 Favored 'Trans proline' 0 N--CA 1.455 -0.788 0 N-CA-C 105.36 -2.592 . . . . 0.0 105.36 165.295 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -47.73 -32.11 5.49 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 116.086 1.884 . . . . 0.0 116.086 -167.133 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.33 -15.12 36.88 Favored Glycine 0 CA--C 1.536 1.364 0 CA-C-N 118.782 0.719 . . . . 0.0 113.769 176.735 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.89 -11.41 46.76 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 126.055 1.742 . . . . 0.0 112.419 170.058 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.0 t -153.74 136.75 15.49 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-O 123.104 1.43 . . . . 0.0 113.058 -178.498 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.0 t -70.52 -53.51 22.28 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 CA-C-N 113.463 -1.699 . . . . 0.0 108.798 176.269 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.9 m -59.73 -41.69 86.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-O 119.264 -0.398 . . . . 0.0 110.029 -178.133 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' CYS . . . . . 0.447 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 10.7 t -64.42 -37.45 87.57 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.51 1.524 . . . . 0.0 110.16 177.953 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 48.8 m -66.17 -23.58 66.49 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 118.949 -0.548 . . . . 0.0 111.264 173.793 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -77.01 -25.85 63.44 Favored Glycine 0 C--N 1.346 1.089 0 CA-C-O 123.194 1.441 . . . . 0.0 111.781 168.911 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.496 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -81.67 -41.67 21.05 Favored 'General case' 0 N--CA 1.428 -1.538 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 -166.114 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 . . . . . 0 C--N 1.323 -0.586 0 CA-C-O 119.174 -0.441 . . . . 0.0 110.647 171.334 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 44.7 t0 . . . . . 0 CA--C 1.541 0.599 0 CA-C-O 118.314 -0.85 . . . . 0.0 110.993 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -55.08 -31.93 77.26 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 124.177 3.251 . . . . 0.0 113.228 -178.737 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 84.4 m -96.77 -11.01 25.54 Favored 'General case' 0 N--CA 1.438 -1.073 0 C-N-CA 126.013 1.725 . . . . 0.0 113.6 -169.354 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.1 tp60 -64.12 -26.03 68.36 Favored 'General case' 0 N--CA 1.444 -0.775 0 CA-C-N 118.294 0.497 . . . . 0.0 110.721 -179.158 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.6 tptt -59.91 -56.11 25.84 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.537 0.735 . . . . 0.0 109.811 169.395 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -60.72 -39.7 89.58 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.117 0.567 . . . . 0.0 109.932 -177.192 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.43 -41.81 85.89 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.991 1.316 . . . . 0.0 112.451 171.728 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 98.3 m -59.71 -44.13 93.82 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.673 0.67 . . . . 0.0 110.627 171.898 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -64.97 -20.11 66.32 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 117.69 -1.148 . . . . 0.0 112.44 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 29.6 mm -59.04 -54.09 38.93 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 CA-C-N 120.538 1.517 . . . . 0.0 109.186 170.09 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 6.7 mm-40 -60.49 -53.38 58.27 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 -178.602 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 24.6 mttm -68.0 -30.29 69.51 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 118.222 -0.894 . . . . 0.0 111.583 -173.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 15.7 t -58.28 -47.73 82.69 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 119.386 0.994 . . . . 0.0 108.52 168.785 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.69 -46.83 83.8 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 118.843 -0.599 . . . . 0.0 110.282 178.991 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -57.55 -44.63 85.34 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.558 0.743 . . . . 0.0 111.419 173.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.85 -13.23 61.38 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 175.143 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 -123.67 8.22 8.86 Favored 'General case' 0 C--N 1.343 0.301 0 C-N-CA 124.725 1.21 . . . . 0.0 112.277 -172.365 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.3 m 58.84 40.14 23.16 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 122.37 1.081 . . . . 0.0 110.774 179.715 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.26 7.1 m-85 72.02 13.93 5.83 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 127.816 2.446 . . . . 0.0 114.563 168.681 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 68.1 mtm -70.77 83.27 0.64 Allowed 'General case' 0 N--CA 1.441 -0.881 0 C-N-CA 125.293 1.437 . . . . 0.0 109.777 170.758 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -54.41 -23.57 16.37 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.914 0.886 . . . . 0.0 111.79 172.894 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 4.3 m -51.98 -42.82 63.24 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 126.096 1.758 . . . . 0.0 111.907 169.815 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 48.4 mmtt -69.54 -48.02 61.79 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 124.559 1.144 . . . . 0.0 108.891 175.204 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.0 m -72.27 1.27 7.99 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 124.584 1.154 . . . . 0.0 113.307 -173.615 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 86.7 mm-40 -55.94 -26.77 49.35 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.477 1.035 . . . . 0.0 111.139 166.936 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.47 -57.9 10.91 Favored 'General case' 0 C--N 1.347 0.466 0 C-N-CA 125.5 1.52 . . . . 0.0 111.677 171.198 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 14.0 p -74.82 -29.47 22.8 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.76 0 C-N-CA 123.68 0.792 . . . . 0.0 110.145 -173.386 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.433 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 63.8 mt -58.77 -50.83 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.649 0 N-CA-C 105.402 -2.073 . . . . 0.0 105.402 167.863 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.403 ' HA ' ' HG3' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -56.28 -35.48 67.53 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 119.232 0.923 . . . . 0.0 112.869 175.077 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -68.31 -35.31 77.63 Favored 'General case' 0 N--CA 1.438 -1.05 0 C-N-CA 118.995 -1.082 . . . . 0.0 110.027 179.565 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.493 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -65.79 -26.33 67.65 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 125.155 1.382 . . . . 0.0 109.885 173.311 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.403 ' HG3' ' HA ' ' A' ' 33' ' ' GLN . 20.0 mmt85 -71.28 -50.92 27.72 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 177.534 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 67.2 mmtt -65.87 -25.08 67.02 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.247 179.26 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 47.6 t -70.36 -55.17 9.77 Favored 'General case' 0 N--CA 1.441 -0.922 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 167.257 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.3 t -60.27 -46.93 88.1 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 121.234 -0.916 . . . . 0.0 112.656 -170.241 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.12 2.05 6.48 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -175.188 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.57 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 11.6 tt0 -90.36 -8.99 49.34 Favored 'General case' 0 N--CA 1.442 -0.837 0 C-N-CA 126.123 1.769 . . . . 0.0 111.234 -175.681 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.57 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 74.9 m-85 -139.45 160.61 61.01 Favored Pre-proline 0 N--CA 1.445 -0.706 0 C-N-CA 124.637 1.175 . . . . 0.0 111.978 -167.998 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -66.12 127.97 18.64 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 N-CA-C 105.574 -2.51 . . . . 0.0 105.574 165.065 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -53.24 -32.26 47.46 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 114.271 1.211 . . . . 0.0 114.271 -166.732 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.82 -9.13 18.37 Favored Glycine 0 CA--C 1.535 1.343 0 C-N-CA 124.566 1.079 . . . . 0.0 114.236 175.819 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.3 tpm_? -68.44 -17.37 64.19 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 126.172 1.789 . . . . 0.0 112.406 169.759 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.9 t -149.97 137.95 20.25 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 122.641 1.21 . . . . 0.0 113.306 -170.869 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 26.2 t -70.11 -56.35 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 113.536 -1.665 . . . . 0.0 108.726 172.691 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 12.5 m -62.87 -41.72 93.71 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 CA-C-O 118.637 -0.696 . . . . 0.0 110.397 -172.822 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 28.0 t -63.06 -33.81 76.23 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.244 1.418 . . . . 0.0 110.118 176.727 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 56.9 m -67.92 -21.09 65.13 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 118.549 -0.739 . . . . 0.0 111.363 172.413 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -75.38 -39.95 34.56 Favored Glycine 0 C--N 1.344 1.004 0 CA-C-O 124.202 2.001 . . . . 0.0 110.796 166.372 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.493 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 1.2 t80 -73.92 -40.55 63.05 Favored 'General case' 0 N--CA 1.417 -2.097 0 CA-C-N 112.016 -2.092 . . . . 0.0 116.546 -163.859 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 . . . . . 0 C--N 1.321 -0.642 0 C-N-CA 119.86 -0.736 . . . . 0.0 110.937 170.652 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 24.6 t0 . . . . . 0 N--CA 1.439 -0.979 0 N-CA-C 104.437 -2.431 . . . . 0.0 104.437 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -56.21 -30.04 78.2 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 123.91 3.073 . . . . 0.0 112.702 -169.832 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 69.7 m -94.25 -10.89 31.47 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.56 1.544 . . . . 0.0 112.772 -171.277 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 22.2 tp60 -63.94 -25.09 67.98 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 118.618 0.645 . . . . 0.0 111.045 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 46.3 tttm -59.76 -55.9 28.5 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.624 1.17 . . . . 0.0 110.024 168.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 -65.25 -33.76 76.76 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.016 0.527 . . . . 0.0 110.072 -178.074 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -62.52 -40.27 96.24 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.535 0.734 . . . . 0.0 112.102 172.604 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 74.2 m -59.03 -44.97 91.81 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.411 0.55 . . . . 0.0 110.017 171.045 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -60.05 -28.1 67.49 Favored 'General case' 0 C--O 1.226 -0.133 0 CA-C-O 117.739 -1.124 . . . . 0.0 112.037 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 43.8 mm -57.76 -55.29 22.42 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.248 0 CA-C-N 120.013 1.279 . . . . 0.0 109.703 173.052 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -57.83 -55.15 38.61 Favored 'General case' 0 N--CA 1.444 -0.725 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 -178.862 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.6 mptp? -66.98 -31.99 72.92 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 118.824 -1.151 . . . . 0.0 111.789 -174.852 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 21.2 t -56.14 -48.46 76.21 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 119.532 1.06 . . . . 0.0 108.746 169.191 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.62 -47.02 85.76 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 123.208 0.603 . . . . 0.0 110.5 179.565 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -57.04 -45.79 82.9 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.608 0.763 . . . . 0.0 111.197 174.367 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.71 -13.12 58.65 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.128 0.971 . . . . 0.0 113.406 175.627 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 -123.66 8.89 8.89 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 124.579 1.152 . . . . 0.0 112.197 -173.438 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 57.91 40.31 25.91 Favored 'General case' 0 C--N 1.345 0.41 0 CA-C-O 122.437 1.113 . . . . 0.0 110.989 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.262 6.8 m-85 72.34 13.93 5.5 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 127.803 2.441 . . . . 0.0 114.445 168.848 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 68.5 mtm -70.67 84.51 0.63 Allowed 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 125.118 1.367 . . . . 0.0 109.866 170.622 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -53.89 -24.01 14.62 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.892 0.877 . . . . 0.0 111.679 171.991 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.7 m -53.37 -40.37 64.94 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.028 1.731 . . . . 0.0 112.304 170.462 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 51.8 mmtt -71.92 -47.48 52.27 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.375 1.07 . . . . 0.0 108.778 174.777 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 71.6 m -72.53 1.89 7.33 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.771 1.229 . . . . 0.0 113.356 -174.978 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 74.7 mm-40 -54.76 -27.54 41.92 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 119.587 1.085 . . . . 0.0 110.911 167.343 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.47 -57.63 12.14 Favored 'General case' 0 C--N 1.347 0.467 0 C-N-CA 126.011 1.724 . . . . 0.0 111.961 172.48 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.0 p -74.41 -29.73 24.71 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.722 0 C-N-CA 123.712 0.805 . . . . 0.0 109.7 -174.333 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.617 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 72.5 mt -61.74 -45.33 98.92 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 169.207 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.64 -38.73 69.93 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 118.702 0.683 . . . . 0.0 111.914 172.551 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -70.93 -40.22 72.21 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 118.482 -1.287 . . . . 0.0 109.966 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.504 HD13 ' CE1' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -66.13 -26.78 67.6 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.877 0.871 . . . . 0.0 109.786 178.026 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.71 -56.03 12.42 Favored 'General case' 0 CA--C 1.513 -0.443 0 C-N-CA 125.193 1.397 . . . . 0.0 108.578 176.38 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 7.9 mptt -61.01 -32.53 72.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 113.519 -1.673 . . . . 0.0 110.436 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 47.4 t -63.94 -55.97 18.61 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 168.394 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 52.8 t -58.89 -46.54 87.62 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 124.007 0.923 . . . . 0.0 112.457 -170.097 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.87 -3.01 13.9 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.249 -0.887 . . . . 0.0 112.833 -177.406 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.453 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 3.1 tp-100 -86.46 -5.74 59.08 Favored 'General case' 0 N--CA 1.438 -1.052 0 C-N-CA 124.57 1.148 . . . . 0.0 111.71 -177.346 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.453 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 79.5 m-85 -138.2 159.78 66.77 Favored Pre-proline 0 N--CA 1.444 -0.747 0 C-N-CA 124.531 1.132 . . . . 0.0 111.261 -168.652 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -66.97 113.11 2.68 Favored 'Trans proline' 0 N--CA 1.454 -0.845 0 N-CA-C 105.159 -2.67 . . . . 0.0 105.159 165.628 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 39.6 mmtm -42.75 -35.62 1.2 Allowed 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 116.306 1.965 . . . . 0.0 116.306 -166.271 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.68 -15.86 20.56 Favored Glycine 0 CA--C 1.539 1.548 0 C-N-CA 124.629 1.109 . . . . 0.0 114.266 175.188 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.2 tpm_? -58.51 -24.22 59.99 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.745 2.018 . . . . 0.0 111.835 169.484 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 8.1 t -145.2 130.72 18.81 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-O 123.359 1.552 . . . . 0.0 112.787 -169.932 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.4 t -68.74 -50.71 52.62 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 CA-C-N 112.681 -2.054 . . . . 0.0 108.566 176.577 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.9 m -61.0 -45.37 98.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 CA-C-O 118.555 -0.735 . . . . 0.0 109.592 -178.191 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 24.4 t -61.65 -35.14 77.1 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.299 1.84 . . . . 0.0 110.304 178.59 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.6 m -66.96 -26.34 66.78 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.188 0.595 . . . . 0.0 111.303 172.776 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.84 -30.87 60.9 Favored Glycine 0 C--N 1.344 1.01 0 CA-C-O 123.437 1.576 . . . . 0.0 111.731 168.14 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.617 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 0.6 OUTLIER -81.36 -41.16 22.41 Favored 'General case' 0 N--CA 1.424 -1.733 0 N-CA-C 117.39 2.367 . . . . 0.0 117.39 -164.393 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 . . . . . 0 C--N 1.322 -0.623 0 CA-C-O 118.9 -0.571 . . . . 0.0 109.565 168.717 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.6 t0 . . . . . 0 CA--C 1.538 0.481 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -60.27 -32.9 94.86 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 123.747 2.965 . . . . 0.0 112.802 -171.208 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 96.3 m -94.14 -12.19 28.9 Favored 'General case' 0 N--CA 1.437 -1.099 0 C-N-CA 124.475 1.11 . . . . 0.0 113.144 -168.614 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 18.8 tp60 -61.38 -26.79 68.07 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 122.756 0.422 . . . . 0.0 110.833 177.762 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 51.9 tptt -60.05 -57.7 11.69 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.451 0.7 . . . . 0.0 109.807 168.901 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -60.28 -37.52 80.73 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 122.983 0.513 . . . . 0.0 110.317 -176.975 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -60.43 -35.82 76.73 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.465 1.106 . . . . 0.0 113.037 172.759 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 75.8 m -64.07 -44.49 92.23 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 118.343 0.52 . . . . 0.0 110.396 169.351 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.4 mm-40 -64.1 -25.09 67.95 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 117.955 -1.022 . . . . 0.0 112.28 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.418 HD13 HG13 ' A' ' 31' ' ' VAL . 46.8 mm -56.44 -50.5 72.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.243 0 CA-C-N 119.964 1.256 . . . . 0.0 109.409 169.251 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 -60.78 -55.39 33.74 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 -175.543 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 48.1 mttt -69.94 -30.58 68.0 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 118.245 -0.884 . . . . 0.0 111.425 -172.289 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 17.3 t -57.14 -46.76 82.42 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 168.923 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.05 -45.95 89.48 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 118.49 -0.767 . . . . 0.0 110.354 179.025 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -58.28 -45.27 88.21 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 119.177 0.899 . . . . 0.0 111.282 174.235 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.07 -13.53 58.21 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.048 0.939 . . . . 0.0 113.306 175.595 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -124.38 9.04 8.46 Favored 'General case' 0 C--N 1.343 0.289 0 C-N-CA 124.425 1.09 . . . . 0.0 112.351 -172.737 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.6 m 57.83 40.45 26.04 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 122.464 1.126 . . . . 0.0 110.814 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.256 6.8 m-85 72.01 13.98 5.84 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 127.852 2.461 . . . . 0.0 114.44 168.781 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 66.1 mtm -70.23 85.6 0.57 Allowed 'General case' 0 N--CA 1.44 -0.931 0 C-N-CA 125.132 1.373 . . . . 0.0 109.723 169.904 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -53.37 -25.69 16.45 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.312 0.645 . . . . 0.0 111.381 170.213 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.1 m -52.31 -38.86 59.62 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 126.744 2.018 . . . . 0.0 112.675 170.801 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.7 mmtm -74.17 -47.51 35.33 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.369 1.068 . . . . 0.0 108.69 173.948 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.2 m -71.71 0.89 7.72 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 124.892 1.277 . . . . 0.0 113.281 -174.496 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 51.6 mm-40 -54.72 -28.26 46.8 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 119.652 1.114 . . . . 0.0 110.242 166.905 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.59 -56.65 19.44 Favored 'General case' 0 C--N 1.346 0.441 0 C-N-CA 125.789 1.636 . . . . 0.0 111.906 171.954 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.418 HG13 HD13 ' A' ' 14' ' ' ILE . 13.4 p -75.77 -28.34 19.31 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.835 0 C-N-CA 123.288 0.635 . . . . 0.0 110.002 -174.113 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.478 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 60.0 mt -61.91 -45.85 97.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 N-CA-C 106.564 -1.643 . . . . 0.0 106.564 168.725 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.92 -38.41 70.24 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 119.202 0.91 . . . . 0.0 112.284 171.129 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -70.26 -37.85 74.98 Favored 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 119.354 -0.938 . . . . 0.0 110.085 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.551 HD13 ' CE1' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -65.28 -30.81 71.71 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 124.673 1.189 . . . . 0.0 108.834 174.957 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.0 mmt-85 -69.96 -49.89 47.31 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -61.02 -35.43 76.85 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-N 114.895 -1.048 . . . . 0.0 110.698 177.96 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 51.0 t -61.81 -57.17 12.89 Favored 'General case' 0 C--O 1.219 -0.551 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 168.748 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 35.4 t -58.39 -44.29 88.89 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 123.856 0.862 . . . . 0.0 112.144 -169.535 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.41 -1.21 10.01 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 124.03 0.932 . . . . 0.0 113.296 -178.327 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.555 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 15.5 tt0 -83.87 -8.85 59.1 Favored 'General case' 0 N--CA 1.444 -0.764 0 C-N-CA 124.435 1.094 . . . . 0.0 111.105 176.902 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.555 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 90.6 m-85 -138.97 158.02 70.49 Favored Pre-proline 0 N--CA 1.441 -0.894 0 C-N-CA 124.979 1.312 . . . . 0.0 112.106 -166.891 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -69.86 111.06 2.73 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 N-CA-C 104.968 -2.743 . . . . 0.0 104.968 165.163 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 64.3 pttt -42.01 -32.57 0.46 Allowed 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 117.964 2.579 . . . . 0.0 117.964 -166.279 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -56.47 -15.76 12.95 Favored Glycine 0 CA--C 1.538 1.509 0 CA-C-N 119.468 1.031 . . . . 0.0 114.177 172.68 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 5.0 tpm_? -54.05 -24.74 18.31 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 127.583 2.353 . . . . 0.0 112.132 168.605 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.3 t -146.76 137.74 24.05 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-O 122.73 1.252 . . . . 0.0 111.82 -170.392 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 18.7 t -66.84 -53.71 31.98 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.677 0 CA-C-N 113.491 -1.686 . . . . 0.0 108.487 177.172 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 3.8 m -60.26 -46.08 95.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-O 118.47 -0.776 . . . . 0.0 109.415 -178.721 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 41.9 t -63.31 -30.22 71.39 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.125 1.37 . . . . 0.0 109.943 -178.258 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 52.3 m -68.45 -27.48 66.21 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.186 0.595 . . . . 0.0 111.277 172.618 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -71.08 -40.42 61.98 Favored Glycine 0 N--CA 1.473 1.113 0 CA-C-O 124.781 2.323 . . . . 0.0 110.752 167.378 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.551 ' CE1' HD13 ' A' ' 35' ' ' LEU . 2.0 t80 -77.54 -35.88 52.87 Favored 'General case' 0 N--CA 1.41 -2.468 0 CA-C-N 111.22 -2.49 . . . . 0.0 116.677 -163.214 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 . . . . . 0 C--N 1.32 -0.711 0 CA-C-O 118.258 -0.877 . . . . 0.0 110.909 169.363 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.0 t0 . . . . . 0 CA--C 1.541 0.619 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_exo -54.97 -30.59 70.1 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 125.175 3.916 . . . . 0.0 113.639 -172.391 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 91.6 m -97.74 -11.87 22.93 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 125.83 1.652 . . . . 0.0 113.261 -169.026 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 23.1 tp60 -62.52 -26.83 68.76 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 118.194 0.452 . . . . 0.0 110.722 -178.934 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 51.5 tttm -58.4 -56.09 26.65 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 123.605 0.762 . . . . 0.0 110.497 169.641 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -62.73 -44.53 95.97 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.3 0.64 . . . . 0.0 109.667 -176.641 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -52.98 -38.76 62.49 Favored 'General case' 0 N--CA 1.462 0.171 0 C-N-CA 125.056 1.343 . . . . 0.0 113.218 173.012 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 66.4 m -60.03 -44.09 94.86 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 120.162 -0.615 . . . . 0.0 110.333 172.252 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -66.75 -27.59 67.73 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 117.324 -1.322 . . . . 0.0 113.196 -179.276 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.8 mp -55.88 -48.82 77.87 Favored 'Isoleucine or valine' 0 C--N 1.343 0.294 0 CA-C-N 121.037 1.744 . . . . 0.0 109.598 169.668 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -59.91 -55.98 27.41 Favored 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 24.3 mmtm -68.86 -31.56 70.61 Favored 'General case' 0 CA--C 1.522 -0.098 0 CA-C-O 118.527 -0.749 . . . . 0.0 112.004 -171.909 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 27.6 t -55.04 -47.01 75.34 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 169.819 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.54 -45.44 91.78 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-O 118.435 -0.793 . . . . 0.0 110.463 179.248 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -57.97 -46.56 84.95 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 119.261 0.937 . . . . 0.0 111.007 174.24 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.62 -14.86 59.86 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.044 0.937 . . . . 0.0 113.365 176.335 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 -120.8 8.34 10.55 Favored 'General case' 0 C--N 1.343 0.298 0 C-N-CA 124.334 1.054 . . . . 0.0 112.056 -174.509 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.5 m 57.56 40.75 26.64 Favored 'General case' 0 C--N 1.345 0.406 0 CA-C-O 122.511 1.148 . . . . 0.0 110.78 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.269 6.9 m-85 72.59 14.39 5.17 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 128.045 2.538 . . . . 0.0 114.48 168.977 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 69.5 mtm -70.08 82.39 0.5 Allowed 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 125.13 1.372 . . . . 0.0 109.941 169.729 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -52.97 -24.44 9.4 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.637 1.175 . . . . 0.0 111.164 169.54 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.0 m -51.4 -44.12 62.12 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 126.107 1.763 . . . . 0.0 112.201 169.786 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.3 mmtt -73.11 -47.77 41.44 Favored 'General case' 0 C--O 1.232 0.182 0 C-N-CA 124.634 1.174 . . . . 0.0 108.963 176.867 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.0 m -69.51 0.61 5.01 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 124.648 1.179 . . . . 0.0 113.073 -176.772 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 52.4 mm-40 -54.9 -30.27 57.91 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 119.887 1.221 . . . . 0.0 110.8 166.907 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.01 -54.79 43.12 Favored 'General case' 0 C--N 1.344 0.367 0 C-N-CA 124.702 1.201 . . . . 0.0 111.463 173.024 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.0 p -75.56 -31.02 22.63 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.727 0 C-N-CA 122.871 0.468 . . . . 0.0 110.405 -174.403 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.56 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 69.1 mt -59.03 -46.32 91.79 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 N-CA-C 106.345 -1.724 . . . . 0.0 106.345 168.649 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.71 -26.48 61.82 Favored 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 121.011 -1.056 . . . . 0.0 113.281 173.706 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -76.49 -37.76 56.32 Favored 'General case' 0 N--CA 1.432 -1.356 0 C-N-CA 119.846 -0.742 . . . . 0.0 110.277 175.16 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.497 ' HB3' ' CE2' ' A' ' 53' ' ' PHE . 2.8 mt -62.6 -32.37 73.36 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-O 117.778 -1.106 . . . . 0.0 109.514 169.5 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.5 mmt180 -62.79 -53.8 48.75 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 120.163 1.347 . . . . 0.0 108.195 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 54.6 mttp -64.2 -34.44 78.1 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.177 -178.748 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 47.5 t -63.25 -51.57 65.63 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 110.105 -0.332 . . . . 0.0 110.105 169.615 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 45.5 t -65.05 -47.77 76.2 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 124.673 1.189 . . . . 0.0 111.84 -169.065 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.93 -1.02 6.35 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 115.551 -0.75 . . . . 0.0 112.331 -175.711 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.563 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 12.0 tt0 -80.28 -11.66 59.7 Favored 'General case' 0 N--CA 1.443 -0.821 0 C-N-CA 125.94 1.696 . . . . 0.0 110.999 176.643 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.563 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 84.9 m-85 -136.42 158.03 74.21 Favored Pre-proline 0 N--CA 1.439 -0.99 0 C-N-CA 125.449 1.499 . . . . 0.0 111.243 -167.814 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -68.25 109.0 1.89 Allowed 'Trans proline' 0 N--CA 1.455 -0.771 0 N-CA-C 104.295 -3.002 . . . . 0.0 104.295 165.124 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.51 -36.49 0.39 Allowed 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 117.739 2.496 . . . . 0.0 117.739 -165.668 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.2 -14.72 12.42 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 124.55 1.071 . . . . 0.0 114.234 174.531 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 35.6 tpt85 -51.99 -33.2 37.12 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 126.986 2.114 . . . . 0.0 111.542 168.768 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.2 t -136.92 139.53 41.63 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-O 122.428 1.109 . . . . 0.0 110.625 -168.449 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 15.3 t -68.15 -54.08 24.71 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.695 0 CA-C-N 114.016 -1.447 . . . . 0.0 108.362 177.862 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 6.8 m -62.48 -42.42 95.67 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.119 -176.267 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 36.7 t -64.06 -32.37 73.89 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.634 1.574 . . . . 0.0 110.284 177.758 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.0 m -69.57 -26.04 64.28 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.83 -0.544 . . . . 0.0 111.131 171.348 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.91 -32.05 66.64 Favored Glycine 0 C--N 1.344 0.985 0 CA-C-O 123.427 1.571 . . . . 0.0 111.266 167.067 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.56 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 1.2 t80 -80.57 -43.23 20.97 Favored 'General case' 0 N--CA 1.417 -2.097 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 -164.206 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 25.6 mm-40 . . . . . 0 CA--C 1.542 0.637 0 C-N-CA 119.634 -0.826 . . . . 0.0 110.4 171.17 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 20.5 t0 . . . . . 0 N--CA 1.447 -0.588 0 N-CA-C 105.941 -1.874 . . . . 0.0 105.941 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -54.7 -34.75 85.13 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 124.497 3.465 . . . . 0.0 112.664 -170.578 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.401 ' HB3' ' CD2' ' A' ' 35' ' ' LEU . 77.5 m -94.48 -13.77 25.82 Favored 'General case' 0 N--CA 1.433 -1.319 0 C-N-CA 125.54 1.536 . . . . 0.0 113.03 -169.313 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 26.2 tp60 -61.85 -25.28 67.43 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 118.754 0.707 . . . . 0.0 111.224 -179.136 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 51.8 tttm -59.53 -56.62 19.71 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.766 1.226 . . . . 0.0 110.166 169.148 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -63.61 -38.23 90.34 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.73 0.812 . . . . 0.0 110.203 -177.461 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.99 -42.17 72.14 Favored 'General case' 0 C--N 1.339 0.148 0 C-N-CA 124.901 1.28 . . . . 0.0 112.816 171.18 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 82.0 m -57.56 -46.48 83.89 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.29 172.713 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -62.99 -25.44 68.38 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 117.84 -1.076 . . . . 0.0 112.253 -178.869 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.408 HD13 HG13 ' A' ' 31' ' ' VAL . 34.6 mm -57.15 -54.47 29.98 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.378 0 CA-C-N 120.019 1.281 . . . . 0.0 109.235 172.909 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 36.7 mm-40 -58.18 -54.47 46.65 Favored 'General case' 0 N--CA 1.443 -0.816 0 O-C-N 124.18 0.925 . . . . 0.0 108.934 -178.547 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -66.5 -32.68 74.18 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 118.925 -1.11 . . . . 0.0 111.693 -175.309 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 25.2 t -56.2 -48.89 75.53 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 119.443 1.02 . . . . 0.0 108.902 169.397 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.73 -46.8 86.55 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 123.244 0.618 . . . . 0.0 110.487 179.826 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -57.11 -45.92 83.04 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.977 0.911 . . . . 0.0 111.199 174.35 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.54 -12.4 52.5 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.18 0.992 . . . . 0.0 113.424 175.3 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 52.2 m-80 -124.67 8.83 8.27 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.688 1.195 . . . . 0.0 112.187 -173.13 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.1 m 57.93 40.31 25.85 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.646 1.112 . . . . 0.0 110.979 179.697 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.265 6.9 m-85 72.17 14.05 5.66 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 127.817 2.447 . . . . 0.0 114.619 168.846 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 64.5 mtm -69.47 86.52 0.44 Allowed 'General case' 0 N--CA 1.44 -0.964 0 C-N-CA 125.127 1.371 . . . . 0.0 109.962 169.9 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -53.5 -26.12 19.42 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.252 1.021 . . . . 0.0 111.21 169.501 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.5 m -57.05 -32.13 65.89 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 127.497 2.319 . . . . 0.0 113.514 170.541 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.5 mmtm -79.62 -45.55 18.89 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.251 1.02 . . . . 0.0 108.769 171.917 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 81.2 m -73.88 9.0 1.67 Allowed 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 125.675 1.59 . . . . 0.0 113.709 -175.117 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 59.9 mm-40 -53.16 -38.14 62.48 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.425 -0.797 . . . . 0.0 110.737 168.049 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.31 -50.11 74.94 Favored 'General case' 0 C--N 1.342 0.242 0 C-N-CA 123.666 0.786 . . . . 0.0 111.631 178.21 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.408 HG13 HD13 ' A' ' 14' ' ' ILE . 8.7 p -75.13 -28.4 20.68 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.841 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.741 -175.889 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.482 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 55.4 mt -61.19 -50.14 81.72 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.637 0 N-CA-C 106.852 -1.536 . . . . 0.0 106.852 169.003 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -55.23 -27.81 48.83 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 123.819 0.848 . . . . 0.0 111.139 176.257 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -74.66 -43.29 56.02 Favored 'General case' 0 N--CA 1.441 -0.91 0 O-C-N 121.75 -0.594 . . . . 0.0 112.421 174.983 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.435 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 2.6 mt -62.14 -30.38 71.0 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 119.393 0.997 . . . . 0.0 110.547 170.417 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.9 ttt-85 -64.78 -58.88 5.04 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 126.433 1.893 . . . . 0.0 110.155 178.953 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.7 ptmt -65.94 -27.98 68.57 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.796 -179.489 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 47.7 t -65.76 -51.44 59.16 Favored 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 168.422 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.1 t -62.9 -48.78 77.49 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.435 0.694 . . . . 0.0 112.186 -169.919 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.48 -2.81 5.07 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 124.176 0.99 . . . . 0.0 112.608 -176.39 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.559 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 14.2 tt0 -79.26 -12.15 59.95 Favored 'General case' 0 N--CA 1.441 -0.883 0 C-N-CA 125.57 1.548 . . . . 0.0 111.032 175.677 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.559 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 83.9 m-85 -135.31 159.22 72.6 Favored Pre-proline 0 N--CA 1.442 -0.833 0 C-N-CA 125.032 1.333 . . . . 0.0 111.801 -167.949 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -69.19 115.14 3.87 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 N-CA-C 104.926 -2.759 . . . . 0.0 104.926 165.157 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.485 ' H ' ' HE2' ' A' ' 44' ' ' LYS . 0.3 OUTLIER -38.6 -44.39 0.97 Allowed 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 116.234 1.939 . . . . 0.0 116.234 -166.417 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -56.89 -12.36 6.87 Favored Glycine 0 CA--C 1.535 1.327 0 C-N-CA 124.842 1.21 . . . . 0.0 114.328 178.105 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 34.8 tpt85 -54.28 -34.24 60.4 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 127.01 2.124 . . . . 0.0 111.91 169.337 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.5 t -143.23 142.13 31.3 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 122.344 1.068 . . . . 0.0 111.055 -168.564 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 6.5 t -70.03 -56.39 11.45 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 CA-C-N 114.257 -1.338 . . . . 0.0 108.84 -179.01 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.2 m -60.23 -37.56 74.06 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 122.927 0.491 . . . . 0.0 110.581 -177.037 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' CYS . . . . . 0.452 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 8.1 t -69.37 -38.29 77.97 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.278 1.031 . . . . 0.0 109.919 177.663 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 44.5 m -65.04 -27.07 68.55 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.605 -0.685 . . . . 0.0 110.506 171.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.61 -25.61 75.42 Favored Glycine 0 C--N 1.343 0.959 0 CA-C-O 121.455 0.475 . . . . 0.0 112.5 169.66 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.482 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 0.3 OUTLIER -80.69 -46.42 15.58 Favored 'General case' 0 N--CA 1.431 -1.412 0 N-CA-C 115.449 1.648 . . . . 0.0 115.449 -165.489 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 . . . . . 0 N--CA 1.444 -0.733 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.925 173.936 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 18.1 t0 . . . . . 0 N--CA 1.448 -0.551 0 N-CA-C 108.185 -1.042 . . . . 0.0 108.185 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -56.84 -34.48 96.86 Favored 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 123.979 3.119 . . . . 0.0 112.699 -170.253 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 69.2 m -94.24 -13.06 26.97 Favored 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 125.134 1.374 . . . . 0.0 112.914 -169.745 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 33.3 tp60 -62.72 -25.81 68.36 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 118.614 0.643 . . . . 0.0 110.827 179.206 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 50.7 tptt -60.11 -54.49 45.3 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 123.336 0.654 . . . . 0.0 110.21 169.238 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -62.98 -38.99 93.38 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.382 0.673 . . . . 0.0 109.907 -177.762 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -55.35 -45.02 76.48 Favored 'General case' 0 CA--C 1.518 -0.288 0 C-N-CA 124.954 1.302 . . . . 0.0 112.406 169.585 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 62.6 m -59.09 -40.34 85.0 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 118.119 0.418 . . . . 0.0 111.337 173.208 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -65.4 -21.52 66.68 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-O 117.776 -1.107 . . . . 0.0 112.679 176.902 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.431 HD13 HG13 ' A' ' 31' ' ' VAL . 28.0 mm -60.26 -50.37 80.51 Favored 'Isoleucine or valine' 0 C--N 1.342 0.28 0 CA-C-N 120.532 1.514 . . . . 0.0 109.388 171.923 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -58.75 -57.08 14.58 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 107.409 -1.33 . . . . 0.0 107.409 179.618 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 42.0 mtpt -68.35 -29.43 68.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 118.597 -0.716 . . . . 0.0 111.701 -169.909 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.402 ' CB ' HG11 ' A' ' 31' ' ' VAL . 25.7 t -56.15 -47.56 77.96 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 118.889 0.768 . . . . 0.0 109.186 169.024 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.41 -44.86 89.22 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 118.662 -0.685 . . . . 0.0 111.086 178.748 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.471 ' HA ' ' CE1' ' A' ' 23' ' ' TYR . 3.0 mp0 -58.37 -43.49 88.48 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 118.214 0.461 . . . . 0.0 111.428 173.665 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.99 -12.44 61.61 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 114.189 1.181 . . . . 0.0 114.189 176.23 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -125.87 15.01 8.02 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 119.673 1.124 . . . . 0.0 113.789 -168.817 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 18.1 m 60.56 35.1 20.16 Favored 'General case' 0 C--N 1.346 0.414 0 CA-C-N 120.619 1.554 . . . . 0.0 110.067 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.471 ' CE1' ' HA ' ' A' ' 19' ' ' GLN . 38.0 m-85 68.18 14.83 9.33 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 126.588 1.955 . . . . 0.0 113.737 167.931 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 62.9 mtm -74.54 89.72 2.2 Favored 'General case' 0 N--CA 1.439 -1.021 0 C-N-CA 126.048 1.739 . . . . 0.0 108.903 175.553 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -55.42 -23.77 26.74 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 119.165 -0.445 . . . . 0.0 111.405 172.762 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.4 m -52.33 -44.69 65.3 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 126.424 1.89 . . . . 0.0 112.098 170.22 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 62.8 mmtt -67.32 -47.65 69.9 Favored 'General case' 0 C--N 1.341 0.205 0 C-N-CA 123.832 0.853 . . . . 0.0 108.959 174.044 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.425 ' O ' HG12 ' A' ' 31' ' ' VAL . 71.8 m -71.31 0.61 7.66 Favored 'General case' 0 N--CA 1.443 -0.791 0 C-N-CA 124.455 1.102 . . . . 0.0 112.945 -174.181 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 -56.59 -25.71 53.48 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 120.042 1.292 . . . . 0.0 111.101 167.186 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.06 -49.43 76.94 Favored 'General case' 0 C--N 1.345 0.381 0 C-N-CA 125.648 1.579 . . . . 0.0 112.174 169.473 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.431 HG13 HD13 ' A' ' 14' ' ' ILE . 7.4 p -82.67 -26.5 8.45 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.877 0 C-N-CA 123.917 0.887 . . . . 0.0 109.88 -174.952 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.5 mp -59.39 -47.06 91.95 Favored 'Isoleucine or valine' 0 C--N 1.348 0.541 0 N-CA-C 105.476 -2.046 . . . . 0.0 105.476 165.418 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.14 -32.53 62.16 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 123.12 0.568 . . . . 0.0 112.002 175.372 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -74.92 -39.88 61.17 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 119.951 -0.7 . . . . 0.0 111.463 178.361 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.496 HD13 ' CE1' ' A' ' 53' ' ' PHE . 1.6 mt -63.6 -35.48 80.65 Favored 'General case' 0 C--N 1.342 0.248 0 CA-C-N 119.217 0.917 . . . . 0.0 110.097 173.57 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.07 -60.46 3.46 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 125.104 1.361 . . . . 0.0 109.592 174.357 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -59.95 -38.54 82.77 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 113.728 -1.578 . . . . 0.0 110.235 -176.632 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 52.3 t -60.44 -52.06 66.84 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 122.937 0.495 . . . . 0.0 109.678 171.253 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 38.1 t -60.15 -43.36 95.82 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 121.09 0.472 . . . . 0.0 111.323 -172.819 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.04 -2.03 6.95 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 125.383 1.473 . . . . 0.0 113.378 179.476 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.556 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 23.3 tt0 -80.46 -8.81 59.69 Favored 'General case' 0 N--CA 1.442 -0.84 0 C-N-CA 123.882 0.873 . . . . 0.0 110.523 171.809 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.556 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 84.6 m-85 -141.07 167.12 18.37 Favored Pre-proline 0 N--CA 1.444 -0.765 0 C-N-CA 125.659 1.584 . . . . 0.0 111.458 -167.847 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -66.24 139.42 55.03 Favored 'Trans proline' 0 CA--C 1.538 0.698 0 N-CA-C 106.633 -2.103 . . . . 0.0 106.633 164.916 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.9 ptpp? -57.92 -26.69 62.55 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 115.115 1.524 . . . . 0.0 115.115 -168.857 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -80.69 0.62 85.66 Favored Glycine 0 CA--C 1.531 1.07 0 C-N-CA 124.24 0.924 . . . . 0.0 113.817 177.338 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 46.0 tpt85 -58.13 -35.97 72.27 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-N 119.368 1.584 . . . . 0.0 112.623 179.217 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -141.14 151.36 43.83 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 124.832 1.253 . . . . 0.0 110.038 -166.258 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 8.8 t -69.02 -56.68 11.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 123.938 0.895 . . . . 0.0 109.259 -177.37 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 9.2 m -59.73 -38.96 78.34 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 C-N-CA 122.954 0.502 . . . . 0.0 109.982 -179.09 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' CYS . . . . . 0.477 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 11.2 t -68.39 -35.37 77.59 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.349 1.06 . . . . 0.0 109.837 179.374 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 48.9 m -64.36 -28.15 69.5 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 121.744 -0.598 . . . . 0.0 110.592 172.491 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -74.38 -25.14 71.28 Favored Glycine 0 C--N 1.344 1.012 0 CA-C-O 121.981 0.767 . . . . 0.0 111.809 172.005 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.496 ' CE1' HD13 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -81.9 -50.25 9.39 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.944 1.698 . . . . 0.0 114.447 -167.805 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 . . . . . 0 N--CA 1.443 -0.824 0 CA-C-N 115.591 -0.732 . . . . 0.0 110.434 174.18 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.6 t0 . . . . . 0 N--CA 1.448 -0.572 0 N-CA-C 102.92 -2.993 . . . . 0.0 102.92 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -66.79 -35.88 26.03 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 123.555 2.837 . . . . 0.0 112.219 -169.494 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 87.5 m -94.77 -13.65 25.45 Favored 'General case' 0 N--CA 1.436 -1.155 0 C-N-CA 124.006 0.922 . . . . 0.0 113.45 -167.349 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.472 ' HA ' HG11 ' A' ' 49' ' ' VAL . 0.8 OUTLIER -51.21 -37.49 47.05 Favored 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 125.289 1.436 . . . . 0.0 111.489 171.899 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -57.23 -58.76 6.8 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 125.323 1.449 . . . . 0.0 110.039 171.913 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -62.39 -36.93 83.85 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.271 0.628 . . . . 0.0 110.774 -176.329 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -57.95 -38.91 76.84 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.617 1.167 . . . . 0.0 112.172 172.658 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 75.5 m -61.36 -43.06 99.51 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 118.399 0.545 . . . . 0.0 110.718 172.974 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -63.79 -22.33 66.86 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 117.95 -1.024 . . . . 0.0 112.328 178.835 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 23.9 mm -60.51 -53.7 45.28 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.334 0 CA-C-N 120.291 1.405 . . . . 0.0 109.277 171.571 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 16.8 mm-40 -61.35 -52.34 65.05 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 -178.239 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 40.7 mtpt -68.13 -30.75 69.97 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 118.29 -0.862 . . . . 0.0 111.354 -174.536 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 14.1 t -58.01 -47.94 81.53 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-N 119.298 0.954 . . . . 0.0 108.444 168.36 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.7 -47.02 83.55 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.287 0.635 . . . . 0.0 110.384 179.068 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -57.46 -44.9 85.19 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.918 0.887 . . . . 0.0 111.193 174.119 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.58 -12.76 59.37 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 175.016 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 47.9 m-80 -124.37 8.63 8.44 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 124.584 1.154 . . . . 0.0 112.308 -172.46 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 58.61 40.11 23.92 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 122.367 1.08 . . . . 0.0 110.915 179.658 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.258 7.1 m-85 71.98 13.98 5.87 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 127.883 2.473 . . . . 0.0 114.619 168.78 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 68.3 mtm -70.63 83.93 0.62 Allowed 'General case' 0 N--CA 1.443 -0.821 0 C-N-CA 125.128 1.371 . . . . 0.0 109.695 170.437 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -54.4 -23.26 15.03 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.687 0.795 . . . . 0.0 111.722 172.283 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.6 m -53.03 -40.87 64.21 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 126.013 1.725 . . . . 0.0 112.273 170.047 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 50.6 mmtt -70.81 -47.69 58.13 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 124.31 1.044 . . . . 0.0 108.809 174.51 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.6 m -73.12 1.37 9.25 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 124.711 1.205 . . . . 0.0 113.267 -173.957 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 76.0 mm-40 -54.41 -31.08 54.31 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 119.485 1.039 . . . . 0.0 110.488 167.242 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.69 -58.23 8.69 Favored 'General case' 0 C--N 1.345 0.39 0 C-N-CA 124.884 1.274 . . . . 0.0 111.463 174.096 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.8 p -74.6 -28.99 22.77 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.91 0 C-N-CA 123.981 0.913 . . . . 0.0 109.995 -173.243 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.469 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 58.1 mt -59.52 -48.99 85.29 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 N-CA-C 105.943 -1.873 . . . . 0.0 105.943 168.043 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.5 ' HA ' ' HG3' ' A' ' 36' ' ' ARG . 0.7 OUTLIER -61.1 -31.6 71.28 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 119.325 0.966 . . . . 0.0 113.097 175.572 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -68.49 -39.92 81.14 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 119.433 1.015 . . . . 0.0 110.089 175.35 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.52 HD13 ' CE1' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -63.33 -29.05 70.43 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 124.648 1.179 . . . . 0.0 108.774 176.037 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.5 ' HG3' ' HA ' ' A' ' 33' ' ' GLN . 10.3 mmt85 -69.68 -50.44 43.85 Favored 'General case' 0 CA--C 1.512 -0.505 0 CA-C-N 119.203 0.91 . . . . 0.0 108.556 -179.881 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 62.9 mmtt -63.07 -32.84 74.3 Favored 'General case' 0 C--O 1.235 0.296 0 O-C-N 123.849 0.718 . . . . 0.0 111.069 178.735 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.2 t -62.5 -54.59 37.71 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 169.132 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 46.5 t -62.88 -47.95 81.11 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 124.058 0.943 . . . . 0.0 111.936 -169.694 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.26 -0.95 5.28 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 124.59 1.156 . . . . 0.0 112.609 -177.467 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.51 ' HB3' ' CE2' ' A' ' 42' ' ' TYR . 2.1 tp-100 -79.13 -11.69 59.98 Favored 'General case' 0 N--CA 1.438 -1.073 0 C-N-CA 123.767 0.827 . . . . 0.0 111.463 172.106 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.51 ' CE2' ' HB3' ' A' ' 41' ' ' GLN . 68.0 m-85 -137.27 156.66 75.21 Favored Pre-proline 0 N--CA 1.443 -0.812 0 C-N-CA 123.972 0.909 . . . . 0.0 112.151 -167.146 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.8 121.5 8.56 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 N-CA-C 105.645 -2.483 . . . . 0.0 105.645 166.501 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -44.5 -40.52 5.67 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 116.306 1.965 . . . . 0.0 116.306 -166.89 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.44 -13.78 31.61 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 123.783 0.706 . . . . 0.0 113.657 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.06 -21.19 66.0 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.859 1.263 . . . . 0.0 112.449 171.093 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.8 t -142.84 137.03 29.33 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-O 122.988 1.375 . . . . 0.0 111.107 -176.44 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 19.3 t -66.98 -53.45 33.93 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.615 0 CA-C-N 113.852 -1.522 . . . . 0.0 108.926 -178.835 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.472 HG11 ' HA ' ' A' ' 8' ' ' GLN . 2.4 m -59.81 -46.65 93.45 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 -178.761 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 42.2 t -63.0 -30.65 71.77 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.952 1.301 . . . . 0.0 109.924 -176.678 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 64.5 m -68.0 -24.81 65.17 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 118.663 -0.684 . . . . 0.0 111.893 174.073 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -74.08 -40.22 43.31 Favored Glycine 0 N--CA 1.471 1.001 0 CA-C-O 124.288 2.049 . . . . 0.0 111.193 167.118 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.52 ' CE1' HD13 ' A' ' 35' ' ' LEU . 2.0 t80 -76.63 -37.67 55.97 Favored 'General case' 0 N--CA 1.411 -2.395 0 CA-C-N 111.055 -2.573 . . . . 0.0 116.848 -162.545 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 . . . . . 0 N--CA 1.449 -0.501 0 C-N-CA 119.651 -0.82 . . . . 0.0 110.766 169.846 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.0 t0 . . . . . 0 CA--C 1.536 0.417 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -51.62 -36.37 60.49 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 124.48 3.453 . . . . 0.0 112.37 -169.702 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 95.4 m -92.97 -8.73 42.25 Favored 'General case' 0 N--CA 1.436 -1.156 0 C-N-CA 126.538 1.935 . . . . 0.0 113.279 -169.152 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 29.4 tp60 -62.89 -24.97 68.08 Favored 'General case' 0 N--CA 1.446 -0.655 0 O-C-N 121.596 -0.69 . . . . 0.0 110.659 178.865 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -57.63 -56.78 17.52 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 123.424 0.689 . . . . 0.0 109.594 168.703 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 20.2 mp0 -59.06 -43.39 91.71 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 123.646 0.778 . . . . 0.0 110.203 -177.654 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.23 -44.11 71.44 Favored 'General case' 0 C--N 1.339 0.133 0 C-N-CA 124.404 1.081 . . . . 0.0 112.209 174.052 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 97.4 m -60.55 -45.64 93.14 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 117.498 0.135 . . . . 0.0 110.915 172.101 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 61.0 mm-40 -63.16 -23.65 67.53 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 117.577 -1.202 . . . . 0.0 112.745 178.941 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 43.7 mm -57.05 -54.16 33.76 Favored 'Isoleucine or valine' 0 C--N 1.342 0.254 0 CA-C-N 120.659 1.572 . . . . 0.0 109.233 172.229 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 34.7 mm-40 -58.75 -54.01 51.88 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 124.02 0.825 . . . . 0.0 109.086 -179.205 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.2 mptp? -66.81 -32.21 73.35 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 118.944 -1.102 . . . . 0.0 111.709 -174.979 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 24.7 t -56.42 -48.35 77.15 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 119.381 0.991 . . . . 0.0 108.841 169.029 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.32 -46.8 85.49 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 123.216 0.606 . . . . 0.0 110.628 179.297 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -56.97 -45.58 82.78 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.739 0.816 . . . . 0.0 111.205 174.021 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.95 -12.57 55.83 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.027 0.931 . . . . 0.0 113.437 175.262 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.7 m-80 -124.31 8.68 8.48 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.617 1.167 . . . . 0.0 112.228 -173.164 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 58.32 40.19 24.75 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 122.426 1.108 . . . . 0.0 110.913 179.619 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.255 6.9 m-85 71.98 13.64 5.92 Favored 'General case' 0 N--CA 1.445 -0.701 0 C-N-CA 127.817 2.447 . . . . 0.0 114.619 168.865 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 67.2 mtm -71.01 83.72 0.69 Allowed 'General case' 0 N--CA 1.44 -0.942 0 C-N-CA 125.144 1.378 . . . . 0.0 109.474 170.566 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -55.89 -22.11 23.9 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.949 0.9 . . . . 0.0 111.973 173.602 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 7.0 m -56.99 -34.18 67.87 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 126.728 2.011 . . . . 0.0 113.086 169.321 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 52.4 mmtt -74.89 -46.2 37.66 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 124.052 0.941 . . . . 0.0 108.74 171.813 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.3 m -73.73 6.13 3.45 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 125.133 1.373 . . . . 0.0 113.191 -174.792 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 40.0 mm-40 -54.93 -31.87 60.72 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 119.182 0.901 . . . . 0.0 110.139 167.138 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.33 -56.86 16.41 Favored 'General case' 0 C--N 1.345 0.391 0 C-N-CA 125.117 1.367 . . . . 0.0 111.433 174.116 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.7 p -73.69 -27.71 23.45 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 C-N-CA 123.843 0.857 . . . . 0.0 110.083 -174.308 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.546 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 63.6 mt -61.03 -49.53 84.34 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 N-CA-C 106.605 -1.628 . . . . 0.0 106.605 168.135 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -55.98 -30.84 62.37 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 118.915 0.78 . . . . 0.0 111.849 174.318 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -69.14 -46.19 68.24 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 118.862 0.756 . . . . 0.0 111.632 173.88 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.494 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.5 mt -55.74 -34.03 64.81 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-N 119.005 0.821 . . . . 0.0 109.577 172.384 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -70.39 -54.72 11.3 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 125.086 1.355 . . . . 0.0 111.648 -176.931 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 62.3 mttm -61.45 -34.7 75.88 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 124.728 1.211 . . . . 0.0 110.779 176.425 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 50.8 t -63.82 -51.01 66.65 Favored 'General case' 0 N--CA 1.444 -0.77 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 169.458 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 53.9 t -61.77 -50.07 73.82 Favored 'General case' 0 CA--C 1.515 -0.379 0 C-N-CA 123.446 0.698 . . . . 0.0 112.084 -172.029 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.51 -1.8 5.53 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 124.629 1.172 . . . . 0.0 111.98 -176.139 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.48 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 2.3 tp-100 -79.64 -8.12 58.99 Favored 'General case' 0 N--CA 1.438 -1.042 0 C-N-CA 124.589 1.156 . . . . 0.0 111.123 174.2 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.48 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 79.2 m-85 -141.6 163.1 43.23 Favored Pre-proline 0 N--CA 1.441 -0.913 0 C-N-CA 125.446 1.498 . . . . 0.0 111.024 -168.264 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -67.81 135.46 35.54 Favored 'Trans proline' 0 CA--C 1.537 0.638 0 N-CA-C 106.35 -2.212 . . . . 0.0 106.35 165.658 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -55.1 -29.47 57.7 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 114.889 1.44 . . . . 0.0 114.889 -168.55 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -67.86 -9.17 55.78 Favored Glycine 0 CA--C 1.533 1.201 0 CA-C-O 119.062 -0.855 . . . . 0.0 113.922 177.278 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 41.4 tpt85 -60.89 -31.97 71.44 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 119.171 1.486 . . . . 0.0 112.221 175.207 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.4 t -144.79 138.19 26.94 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 123.538 0.735 . . . . 0.0 110.273 -168.116 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 11.0 t -63.59 -56.75 15.15 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 CA-C-N 114.748 -1.115 . . . . 0.0 108.743 -178.365 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.2 m -59.01 -40.7 81.28 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 123.571 0.748 . . . . 0.0 110.438 -176.281 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' CYS . . . . . 0.412 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 6.9 t -66.64 -37.84 85.67 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.82 1.248 . . . . 0.0 109.648 179.016 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 27.1 p -65.56 -25.07 67.26 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 121.788 -0.57 . . . . 0.0 111.051 174.207 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.89 -26.77 68.26 Favored Glycine 0 C--N 1.346 1.095 0 CA-C-O 121.759 0.644 . . . . 0.0 112.423 170.049 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.546 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 0.4 OUTLIER -80.43 -46.51 15.84 Favored 'General case' 0 N--CA 1.429 -1.523 0 N-CA-C 116.043 1.868 . . . . 0.0 116.043 -164.641 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 71.2 mt-10 . . . . . 0 CA--C 1.542 0.657 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.54 172.291 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.4 t0 . . . . . 0 N--CA 1.446 -0.667 0 N-CA-C 106.288 -1.745 . . . . 0.0 106.288 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -60.18 -37.23 84.9 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 123.211 2.607 . . . . 0.0 111.964 -171.229 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 93.5 m -92.01 -9.51 42.61 Favored 'General case' 0 N--CA 1.443 -0.791 0 C-N-CA 125.189 1.396 . . . . 0.0 113.047 -167.93 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 20.1 tp60 -59.53 -25.51 64.57 Favored 'General case' 0 N--CA 1.439 -0.993 0 CA-C-O 118.99 -0.529 . . . . 0.0 110.063 172.087 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 56.5 tptt -56.35 -61.68 2.24 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.895 1.278 . . . . 0.0 109.122 167.439 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 19.5 mp0 -57.91 -42.34 84.54 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 118.826 -0.607 . . . . 0.0 110.36 -177.431 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -56.56 -40.52 75.32 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.495 1.118 . . . . 0.0 112.388 174.708 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 96.6 m -64.63 -45.01 88.67 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 123.338 0.655 . . . . 0.0 111.27 170.234 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -63.76 -26.33 68.59 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-O 117.434 -1.269 . . . . 0.0 111.958 -179.299 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.601 HD13 HG22 ' A' ' 31' ' ' VAL . 12.1 mm -57.06 -50.11 77.42 Favored 'Isoleucine or valine' 0 C--N 1.34 0.192 0 CA-C-N 120.439 1.472 . . . . 0.0 109.036 170.311 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 47.2 mm-40 -60.18 -49.54 77.24 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 -174.127 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 26.8 mttp -71.71 -37.51 70.64 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 124.272 1.029 . . . . 0.0 111.943 -176.913 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 11.3 t -53.23 -43.34 67.21 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 108.463 -0.939 . . . . 0.0 108.463 169.696 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.01 -45.61 90.26 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 -178.075 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.414 ' HA ' ' CE1' ' A' ' 23' ' ' TYR . 5.1 mm-40 -64.57 -41.78 96.06 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 123.852 0.861 . . . . 0.0 110.521 179.11 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.22 -11.93 17.44 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.172 0.804 . . . . 0.0 113.172 171.639 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 55.4 m-80 -126.32 9.65 7.3 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.067 1.347 . . . . 0.0 112.257 -175.333 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 12.6 m 54.48 42.01 31.61 Favored 'General case' 0 C--N 1.345 0.389 0 CA-C-O 122.68 1.229 . . . . 0.0 111.983 -178.16 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.414 ' CE1' ' HA ' ' A' ' 19' ' ' GLN 0.264 7.3 m-85 73.36 13.45 4.61 Favored 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 128.523 2.729 . . . . 0.0 114.526 168.046 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 66.7 mtm -69.6 85.02 0.44 Allowed 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 125.121 1.368 . . . . 0.0 109.761 169.842 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -54.46 -23.65 16.99 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.376 0.671 . . . . 0.0 111.538 171.09 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.1 m -52.73 -41.29 63.84 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 126.161 1.784 . . . . 0.0 112.151 170.082 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.3 mmtm -71.85 -47.8 50.54 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.28 1.032 . . . . 0.0 108.926 175.034 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.3 m -70.95 1.0 6.16 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 124.679 1.191 . . . . 0.0 112.919 -175.758 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 74.0 mm-40 -55.45 -29.53 58.84 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 119.635 1.107 . . . . 0.0 110.131 166.37 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.29 -59.25 5.21 Favored 'General case' 0 C--N 1.345 0.378 0 C-N-CA 124.946 1.298 . . . . 0.0 111.371 173.667 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.601 HG22 HD13 ' A' ' 14' ' ' ILE . 14.9 p -72.46 -29.15 30.18 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.819 0 C-N-CA 124.057 0.943 . . . . 0.0 109.909 -174.418 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 60.9 mt -60.69 -48.53 88.32 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 N-CA-C 106.263 -1.754 . . . . 0.0 106.263 169.077 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.407 ' HA ' ' HG3' ' A' ' 36' ' ' ARG . 0.9 OUTLIER -61.6 -28.99 69.75 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 119.637 1.108 . . . . 0.0 113.224 174.192 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 46.4 tt0 -67.11 -39.18 86.65 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 119.419 1.009 . . . . 0.0 109.973 172.989 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.532 HD13 ' CE1' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -60.07 -30.48 69.25 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 125.726 1.61 . . . . 0.0 109.084 175.294 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.407 ' HG3' ' HA ' ' A' ' 33' ' ' GLN . 18.9 mmt85 -71.89 -50.94 24.91 Favored 'General case' 0 C--N 1.343 0.292 0 C-N-CA 123.982 0.913 . . . . 0.0 108.567 -179.427 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -63.51 -29.78 71.0 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 124.755 1.222 . . . . 0.0 111.224 178.358 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 51.7 t -67.96 -55.44 12.73 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 167.406 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 44.3 t -59.61 -44.32 93.45 Favored 'General case' 0 C--N 1.328 -0.336 0 O-C-N 121.107 -0.995 . . . . 0.0 112.904 -170.253 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.25 -0.67 10.45 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 113.216 0.821 . . . . 0.0 113.216 -174.355 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.557 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 13.2 tt0 -93.62 -9.31 38.41 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 126.891 2.076 . . . . 0.0 111.914 -169.695 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.557 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 81.2 m-85 -133.84 163.08 53.72 Favored Pre-proline 0 N--CA 1.448 -0.537 0 C-N-CA 124.681 1.193 . . . . 0.0 111.625 -167.753 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -68.84 94.26 0.45 Allowed 'Trans proline' 0 N--CA 1.456 -0.723 0 N-CA-C 104.743 -2.83 . . . . 0.0 104.743 164.827 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.512 ' H ' ' HD2' ' A' ' 44' ' ' LYS . 2.7 mptp? -39.08 -28.74 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 128.498 2.719 . . . . 0.0 117.898 -164.803 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -56.27 -17.11 16.82 Favored Glycine 0 CA--C 1.54 1.636 0 CA-C-N 120.033 1.288 . . . . 0.0 113.597 169.162 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -54.4 -24.1 18.47 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 127.965 2.506 . . . . 0.0 111.52 168.63 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.6 t -140.5 132.26 27.4 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-O 123.355 1.55 . . . . 0.0 113.33 -172.344 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 20.9 t -70.54 -52.23 30.8 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.717 0 CA-C-N 112.723 -2.035 . . . . 0.0 108.887 176.548 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.9 m -59.38 -45.49 93.39 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 CA-C-O 118.828 -0.606 . . . . 0.0 109.542 -179.655 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 35.1 t -62.88 -33.27 74.94 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.684 1.594 . . . . 0.0 109.953 -179.902 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 54.4 m -66.39 -25.19 66.66 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.24 0.616 . . . . 0.0 111.391 173.043 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.38 -47.57 28.22 Favored Glycine 0 N--CA 1.473 1.163 0 CA-C-O 124.527 2.182 . . . . 0.0 109.638 166.588 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.532 ' CE1' HD13 ' A' ' 35' ' ' LEU . 1.6 t80 -66.58 -36.6 83.02 Favored 'General case' 0 N--CA 1.408 -2.528 0 CA-C-N 110.917 -2.642 . . . . 0.0 116.325 -164.659 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 . . . . . 0 C--N 1.32 -0.681 0 CA-C-O 118.281 -0.866 . . . . 0.0 111.634 173.688 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.3 t0 . . . . . 0 CA--C 1.536 0.428 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -55.9 -29.85 74.73 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 124.54 3.493 . . . . 0.0 113.325 -171.998 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.419 ' HB3' ' CD2' ' A' ' 35' ' ' LEU . 88.7 m -96.78 -12.62 23.42 Favored 'General case' 0 N--CA 1.433 -1.28 0 C-N-CA 125.922 1.689 . . . . 0.0 113.905 -168.504 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 18.9 tp60 -62.02 -24.7 67.22 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 117.98 0.355 . . . . 0.0 111.627 -176.151 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.4 ttpp -70.88 -45.86 63.63 Favored 'General case' 0 CA--C 1.532 0.275 0 O-C-N 121.522 -0.736 . . . . 0.0 111.043 173.422 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -63.26 -40.36 97.19 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.458 0.703 . . . . 0.0 109.892 178.78 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -53.15 -40.51 64.32 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 124.631 1.172 . . . . 0.0 113.046 169.868 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 72.2 m -58.71 -46.05 88.18 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 110.443 -0.206 . . . . 0.0 110.443 174.022 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -60.93 -27.9 68.55 Favored 'General case' 0 CA--C 1.528 0.127 0 CA-C-O 118.112 -0.947 . . . . 0.0 112.691 178.437 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 21.8 mm -57.92 -54.32 33.49 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.473 0 CA-C-N 119.444 1.02 . . . . 0.0 109.339 173.522 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 36.0 mm-40 -58.15 -55.14 38.78 Favored 'General case' 0 N--CA 1.444 -0.764 0 O-C-N 124.365 1.041 . . . . 0.0 108.864 -177.663 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.65 -32.96 74.62 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 118.209 -1.396 . . . . 0.0 112.045 -175.855 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 31.0 t -56.46 -47.5 79.04 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 119.483 1.038 . . . . 0.0 109.127 169.561 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.96 -46.57 87.74 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 123.59 0.756 . . . . 0.0 110.629 179.368 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -57.08 -44.2 82.89 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.878 0.871 . . . . 0.0 111.293 173.546 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.91 -11.81 57.41 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.039 0.935 . . . . 0.0 113.434 174.891 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 50.2 m-80 -126.42 9.47 7.21 Favored 'General case' 0 C--N 1.343 0.31 0 C-N-CA 124.507 1.123 . . . . 0.0 112.656 -172.543 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 14.8 m 58.12 40.51 25.06 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 122.445 1.117 . . . . 0.0 111.05 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.255 6.7 m-85 71.99 13.02 6.0 Favored 'General case' 0 N--CA 1.444 -0.736 0 C-N-CA 127.888 2.475 . . . . 0.0 114.791 168.448 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 63.4 mtm -69.61 86.92 0.47 Allowed 'General case' 0 N--CA 1.441 -0.91 0 C-N-CA 125.116 1.367 . . . . 0.0 109.917 170.678 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -56.05 -20.94 19.01 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.089 0.556 . . . . 0.0 111.7 170.05 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 6.4 m -58.25 -37.39 74.84 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 127.56 2.344 . . . . 0.0 113.014 169.333 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 56.9 mmtt -75.75 -48.68 20.8 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 124.252 1.021 . . . . 0.0 108.736 173.281 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 83.9 m -71.33 6.57 1.68 Allowed 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 125.338 1.455 . . . . 0.0 112.95 -177.687 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -52.14 -32.34 35.24 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 120.129 1.332 . . . . 0.0 111.914 169.416 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.56 -56.23 24.54 Favored 'General case' 0 C--N 1.342 0.282 0 C-N-CA 125.117 1.367 . . . . 0.0 111.649 173.035 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.8 p -75.49 -29.51 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.872 0 C-N-CA 124.004 0.922 . . . . 0.0 109.934 -174.763 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.431 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 1.5 mp -58.38 -49.35 82.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 N-CA-C 105.648 -1.982 . . . . 0.0 105.648 167.905 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.75 -22.77 62.55 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 118.896 0.771 . . . . 0.0 112.778 177.987 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -76.82 -41.44 44.33 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 119.39 -0.924 . . . . 0.0 110.406 173.43 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.455 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 2.7 mt -62.8 -30.85 71.78 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 119.364 0.984 . . . . 0.0 110.667 170.354 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.2 mmt85 -62.4 -57.68 10.4 Favored 'General case' 0 C--N 1.339 0.135 0 CA-C-N 119.73 1.15 . . . . 0.0 108.307 176.266 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 20.4 pttm -69.62 -23.09 63.45 Favored 'General case' 0 C--O 1.234 0.241 0 O-C-N 123.484 0.49 . . . . 0.0 111.46 -175.042 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 46.7 t -68.21 -54.15 19.83 Favored 'General case' 0 N--CA 1.439 -1.0 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 166.803 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.0 t -61.55 -50.59 72.04 Favored 'General case' 0 CA--C 1.516 -0.362 0 C-N-CA 124.691 1.196 . . . . 0.0 112.912 -169.33 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.76 0.06 3.65 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.988 0.915 . . . . 0.0 112.82 -173.803 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.556 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 10.6 tt0 -84.58 -8.87 58.75 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 127.041 2.136 . . . . 0.0 111.378 179.075 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.556 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 81.5 m-85 -137.46 155.76 75.31 Favored Pre-proline 0 N--CA 1.439 -1.011 0 C-N-CA 126.813 2.045 . . . . 0.0 110.87 -166.635 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -69.51 105.99 1.54 Allowed 'Trans proline' 0 N--CA 1.457 -0.653 0 N-CA-C 104.233 -3.026 . . . . 0.0 104.233 165.754 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 63.0 pttt -39.27 -34.25 0.18 Allowed 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 118.772 2.878 . . . . 0.0 118.772 -163.96 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -55.3 -18.75 14.78 Favored Glycine 0 CA--C 1.541 1.684 0 CA-C-N 120.346 1.43 . . . . 0.0 114.202 172.554 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 4.2 tpm_? -57.82 -15.73 9.26 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 128.069 2.547 . . . . 0.0 112.598 169.056 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.1 t -148.49 137.52 21.72 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-O 122.816 1.293 . . . . 0.0 111.587 177.894 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 15.9 t -68.08 -53.25 31.0 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 CA-C-N 113.867 -1.515 . . . . 0.0 108.664 177.369 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.6 m -60.57 -42.29 91.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 CA-C-O 118.768 -0.634 . . . . 0.0 110.217 -177.501 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' CYS . . . . . 0.424 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 13.0 t -64.61 -36.36 83.99 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.953 1.701 . . . . 0.0 110.274 177.892 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.9 m -66.04 -27.18 67.91 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 119.081 -0.485 . . . . 0.0 110.686 172.226 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.69 -36.18 67.04 Favored Glycine 0 C--N 1.343 0.968 0 CA-C-O 123.072 1.373 . . . . 0.0 111.457 168.417 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.455 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.8 OUTLIER -73.51 -42.5 61.72 Favored 'General case' 0 N--CA 1.422 -1.869 0 N-CA-C 116.438 2.014 . . . . 0.0 116.438 -164.783 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 . . . . . 0 N--CA 1.446 -0.635 0 CA-C-O 118.472 -0.775 . . . . 0.0 110.359 174.82 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 37.1 t0 . . . . . 0 N--CA 1.449 -0.493 0 N-CA-C 108.65 -0.871 . . . . 0.0 108.65 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -58.51 -31.03 93.47 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 123.988 3.125 . . . . 0.0 112.865 -174.465 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 56.2 m -93.75 -10.27 34.81 Favored 'General case' 0 N--CA 1.438 -1.041 0 C-N-CA 125.06 1.344 . . . . 0.0 112.523 -171.91 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.6 tp60 -62.74 -26.58 68.77 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 118.821 0.737 . . . . 0.0 110.623 178.344 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -56.48 -54.09 49.84 Favored 'General case' 0 C--O 1.226 -0.168 0 C-N-CA 123.745 0.818 . . . . 0.0 109.942 169.364 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -63.94 -46.79 83.15 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 118.47 -0.776 . . . . 0.0 109.604 -178.202 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -51.06 -40.05 57.42 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.772 1.229 . . . . 0.0 112.969 171.3 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 61.2 m -62.2 -43.0 99.81 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 119.407 -0.33 . . . . 0.0 110.642 172.2 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -64.73 -29.97 70.96 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 117.346 -1.311 . . . . 0.0 112.981 177.339 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.9 mp -57.39 -50.58 76.49 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 CA-C-N 121.021 1.737 . . . . 0.0 109.166 169.26 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 34.2 mm-40 -59.53 -54.59 44.79 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 178.584 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 53.6 mmtt -68.42 -30.8 69.78 Favored 'General case' 0 C--O 1.227 -0.116 0 C-N-CA 118.697 -1.201 . . . . 0.0 111.418 -172.807 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 19.9 t -56.21 -48.94 75.44 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 168.488 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.68 -47.35 82.58 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 118.866 -0.588 . . . . 0.0 110.523 178.808 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -56.74 -46.49 81.33 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.528 0.731 . . . . 0.0 111.199 174.618 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.71 -13.71 59.82 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.113 0.965 . . . . 0.0 113.518 175.759 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.6 m-80 -122.05 8.18 9.82 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 124.772 1.229 . . . . 0.0 111.946 -173.385 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 58.08 40.42 25.25 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 119.566 1.076 . . . . 0.0 110.853 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.261 7.0 m-85 72.29 14.27 5.51 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 127.816 2.447 . . . . 0.0 114.457 168.876 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 68.4 mtm -70.4 82.42 0.56 Allowed 'General case' 0 N--CA 1.441 -0.882 0 C-N-CA 125.212 1.405 . . . . 0.0 109.793 169.836 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -53.19 -24.14 10.17 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.366 1.066 . . . . 0.0 111.668 171.684 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.6 m -52.11 -40.08 60.76 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 126.517 1.927 . . . . 0.0 112.409 170.113 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 45.7 mmtt -72.16 -48.62 42.07 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 124.481 1.113 . . . . 0.0 108.706 174.813 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 78.9 m -73.59 1.38 10.21 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.299 1.44 . . . . 0.0 113.614 -173.763 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 53.4 mm-40 -52.65 -34.13 50.1 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 119.681 1.128 . . . . 0.0 111.222 169.123 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.23 -54.86 42.02 Favored 'General case' 0 C--N 1.343 0.291 0 C-N-CA 125.02 1.328 . . . . 0.0 111.387 175.011 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.0 p -75.59 -31.19 22.81 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.831 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.236 -173.034 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 75.2 mt -58.98 -45.9 91.87 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 N-CA-C 106.656 -1.609 . . . . 0.0 106.656 168.489 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.37 -27.57 62.42 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 120.969 -1.082 . . . . 0.0 113.052 173.662 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -76.47 -29.78 57.03 Favored 'General case' 0 N--CA 1.437 -1.097 0 C-N-CA 119.571 -0.851 . . . . 0.0 110.86 175.656 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.434 ' HB3' ' CE2' ' A' ' 53' ' ' PHE . 3.6 mt -64.45 -29.71 70.76 Favored 'General case' 0 C--N 1.343 0.311 0 CA-C-N 119.688 1.131 . . . . 0.0 109.213 168.648 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 16.7 mmt85 -66.03 -55.81 14.77 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 119.805 1.184 . . . . 0.0 108.719 -178.808 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.9 pttp -66.25 -27.11 67.71 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.157 -178.83 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 42.7 t -65.43 -54.83 22.93 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 168.397 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.1 t -62.55 -46.38 88.63 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 124.127 0.971 . . . . 0.0 112.137 -169.191 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.55 -4.02 10.44 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.003 -0.999 . . . . 0.0 112.879 -178.241 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.421 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 2.8 tp-100 -86.2 -6.2 59.04 Favored 'General case' 0 N--CA 1.439 -1.014 0 C-N-CA 124.851 1.26 . . . . 0.0 111.697 -178.753 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.421 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 72.3 m-85 -136.0 159.76 69.87 Favored Pre-proline 0 N--CA 1.446 -0.642 0 C-N-CA 124.434 1.094 . . . . 0.0 111.387 -168.949 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -67.76 109.24 1.84 Allowed 'Trans proline' 0 N--CA 1.455 -0.764 0 N-CA-C 104.778 -2.816 . . . . 0.0 104.778 165.389 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 38.5 mmtm -39.78 -38.43 0.65 Allowed 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 117.164 2.283 . . . . 0.0 117.164 -165.372 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.58 -17.23 25.86 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 123.854 0.74 . . . . 0.0 113.936 175.718 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 2.0 ttm180 -66.77 -8.08 25.83 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 126.946 2.098 . . . . 0.0 112.653 172.266 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 5.8 t -147.34 136.21 22.14 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 122.912 1.339 . . . . 0.0 112.076 174.415 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 19.9 t -71.73 -50.78 36.54 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.74 0 CA-C-N 113.615 -1.63 . . . . 0.0 108.762 176.717 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.4 m -60.34 -43.68 94.25 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.335 0 CA-C-O 118.402 -0.809 . . . . 0.0 109.835 179.722 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 25.5 t -63.22 -34.57 77.94 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.011 1.724 . . . . 0.0 110.451 178.131 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 48.7 m -65.73 -28.93 69.41 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 122.998 0.519 . . . . 0.0 110.875 171.588 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -67.68 -40.71 90.19 Favored Glycine 0 C--N 1.344 0.995 0 CA-C-O 124.167 1.982 . . . . 0.0 110.952 167.432 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.434 ' CE2' ' HB3' ' A' ' 35' ' ' LEU . 1.2 t80 -73.94 -40.29 63.18 Favored 'General case' 0 N--CA 1.417 -2.122 0 CA-C-N 111.786 -2.207 . . . . 0.0 116.128 -164.581 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 . . . . . 0 C--N 1.322 -0.614 0 CA-C-O 118.324 -0.846 . . . . 0.0 110.638 170.929 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.8 t0 . . . . . 0 CA--C 1.539 0.553 0 N-CA-C 106.245 -1.761 . . . . 0.0 106.245 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -68.67 -17.79 42.63 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 125.097 3.865 . . . . 0.0 113.672 -169.532 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.417 ' HB3' ' CD2' ' A' ' 35' ' ' LEU . 98.6 m -105.32 -9.3 17.7 Favored 'General case' 0 N--CA 1.435 -1.224 0 C-N-CA 127.056 2.143 . . . . 0.0 111.835 -170.451 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 16.9 tp60 -67.41 -22.48 65.53 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.704 -171.467 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -70.36 -46.79 63.41 Favored 'General case' 0 C--O 1.225 -0.232 0 O-C-N 121.449 -0.782 . . . . 0.0 110.057 173.687 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 19.0 mp0 -65.27 -40.57 94.1 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 127.255 2.222 . . . . 0.0 108.237 -172.583 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -52.16 -43.26 63.99 Favored 'General case' 0 C--N 1.34 0.166 0 C-N-CA 126.166 1.787 . . . . 0.0 112.707 169.232 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 84.0 m -60.99 -45.13 96.06 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.925 0.393 . . . . 0.0 110.299 175.709 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -63.83 -22.54 66.96 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 117.711 -1.137 . . . . 0.0 112.541 179.278 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 31.6 mm -59.17 -54.72 30.36 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.216 0 CA-C-N 120.408 1.458 . . . . 0.0 109.17 171.271 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -61.52 -51.79 67.15 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 -177.739 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 16.6 mtpp -67.9 -30.72 70.14 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 118.245 -0.884 . . . . 0.0 111.568 -174.725 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 15.6 t -58.51 -47.87 82.71 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-N 119.41 1.004 . . . . 0.0 108.512 168.787 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.72 -47.15 83.24 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 123.339 0.655 . . . . 0.0 110.392 178.997 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -58.45 -42.23 86.9 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.983 0.913 . . . . 0.0 111.681 174.195 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.63 -10.68 57.58 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 174.374 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -128.33 9.02 6.07 Favored 'General case' 0 C--N 1.344 0.362 0 CA-C-N 119.421 1.009 . . . . 0.0 112.59 -171.852 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 16.2 m 61.03 38.87 16.96 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 119.496 1.044 . . . . 0.0 110.39 177.777 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.265 7.1 m-85 72.2 14.81 5.52 Favored 'General case' 0 N--CA 1.444 -0.735 0 C-N-CA 127.656 2.382 . . . . 0.0 114.431 168.788 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 58.7 mtm -70.9 85.94 0.69 Allowed 'General case' 0 N--CA 1.441 -0.9 0 C-N-CA 124.84 1.256 . . . . 0.0 109.881 170.616 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -52.56 -24.85 9.0 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.265 1.026 . . . . 0.0 111.149 169.556 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.4 m -53.77 -38.83 64.86 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 127.511 2.324 . . . . 0.0 113.013 170.409 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.411 ' HA ' ' HE2' ' A' ' 27' ' ' LYS . 9.9 mmpt? -75.74 -47.6 25.33 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 173.45 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.6 m -71.89 2.64 5.22 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.626 1.17 . . . . 0.0 113.401 -174.568 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -52.98 -30.96 38.16 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 119.439 1.018 . . . . 0.0 110.695 167.763 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.65 -59.58 5.21 Favored 'General case' 0 C--N 1.346 0.444 0 C-N-CA 125.616 1.566 . . . . 0.0 111.68 173.7 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.5 p -71.29 -29.5 36.14 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.716 0 C-N-CA 123.761 0.825 . . . . 0.0 110.08 -174.27 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.573 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 71.7 mt -59.91 -49.85 82.34 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 N-CA-C 106.543 -1.651 . . . . 0.0 106.543 169.239 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -56.86 -25.3 56.19 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 119.451 1.023 . . . . 0.0 112.909 175.482 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -74.84 -41.55 59.66 Favored 'General case' 0 N--CA 1.44 -0.953 0 CA-C-N 118.925 0.784 . . . . 0.0 110.819 173.802 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.47 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 2.4 mt -62.92 -31.31 72.35 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-O 117.797 -1.097 . . . . 0.0 110.208 170.447 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.9 mmt85 -63.37 -56.4 16.64 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 120.067 1.303 . . . . 0.0 108.443 179.076 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.8 pttt -67.65 -28.4 67.68 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.951 -174.517 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 47.8 t -66.55 -54.51 22.86 Favored 'General case' 0 N--CA 1.44 -0.925 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 168.246 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.8 t -59.48 -50.06 75.4 Favored 'General case' 0 CA--C 1.512 -0.512 0 C-N-CA 124.332 1.053 . . . . 0.0 111.842 -169.573 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.11 -1.53 6.15 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.025 -0.989 . . . . 0.0 112.414 -174.608 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.511 ' HB3' ' CE2' ' A' ' 42' ' ' TYR . 2.0 tp-100 -81.9 -10.28 59.34 Favored 'General case' 0 N--CA 1.436 -1.158 0 C-N-CA 124.344 1.058 . . . . 0.0 111.578 174.76 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.511 ' CE2' ' HB3' ' A' ' 41' ' ' GLN . 68.7 m-85 -138.71 158.91 69.32 Favored Pre-proline 0 N--CA 1.445 -0.712 0 C-N-CA 124.187 0.995 . . . . 0.0 112.014 -167.666 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -72.1 147.62 48.92 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 121.735 1.623 . . . . 0.0 108.373 167.622 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -51.94 -42.93 63.23 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 -173.669 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.96 -14.24 23.11 Favored Glycine 0 CA--C 1.53 0.974 0 CA-C-O 119.032 -0.871 . . . . 0.0 113.257 -178.858 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.54 -17.08 56.71 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 118.894 1.347 . . . . 0.0 113.095 176.052 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 9.6 t -151.95 128.51 10.74 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-O 123.537 1.636 . . . . 0.0 112.901 -175.234 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 12.0 t -68.5 -50.85 52.56 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 CA-C-N 112.679 -2.055 . . . . 0.0 108.698 178.942 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 16.0 m -61.84 -43.53 97.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 CA-C-O 118.46 -0.781 . . . . 0.0 110.083 -178.578 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 18.5 t -63.86 -34.58 78.26 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.582 1.553 . . . . 0.0 110.227 177.886 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.0 m -65.07 -29.64 70.54 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 122.788 0.435 . . . . 0.0 110.675 171.99 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.1 -37.54 82.44 Favored Glycine 0 C--N 1.344 1.002 0 CA-C-O 123.089 1.383 . . . . 0.0 111.104 167.987 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.573 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 1.3 t80 -75.08 -40.25 60.25 Favored 'General case' 0 N--CA 1.417 -2.075 0 N-CA-C 117.097 2.258 . . . . 0.0 117.097 -163.74 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 . . . . . 0 CA--C 1.542 0.651 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.674 171.853 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.0 t0 . . . . . 0 N--CA 1.446 -0.669 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -55.25 -34.58 88.75 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 124.091 3.194 . . . . 0.0 112.77 -173.695 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 85.7 m -94.9 -13.09 25.76 Favored 'General case' 0 N--CA 1.436 -1.168 0 C-N-CA 125.403 1.481 . . . . 0.0 113.581 -168.305 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.1 tp60 -61.29 -26.57 67.87 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 122.99 0.516 . . . . 0.0 110.803 -179.968 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.2 ttpp -62.29 -54.31 42.57 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.521 0.728 . . . . 0.0 110.377 169.971 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 27.1 mm-40 -59.12 -44.83 92.04 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.405 0.682 . . . . 0.0 110.107 -177.293 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -51.26 -42.58 61.17 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 125.728 1.611 . . . . 0.0 112.626 170.846 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.425 ' HB3' ' HE2' ' A' ' 16' ' ' LYS . 93.8 m -61.66 -46.27 90.45 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 117.854 0.297 . . . . 0.0 110.931 173.004 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -62.59 -22.22 66.21 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 117.662 -1.161 . . . . 0.0 112.633 179.091 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 27.3 mm -57.78 -53.61 42.67 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.218 0 CA-C-N 120.397 1.453 . . . . 0.0 109.614 171.796 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 -58.64 -55.85 29.75 Favored 'General case' 0 N--CA 1.445 -0.678 0 O-C-N 124.19 0.932 . . . . 0.0 109.002 -179.316 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.425 ' HE2' ' HB3' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -66.65 -31.54 72.28 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 118.807 -1.157 . . . . 0.0 112.138 -175.004 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 24.1 t -55.67 -48.72 74.58 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 119.491 1.041 . . . . 0.0 108.758 169.18 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.44 -46.7 86.02 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-O 118.863 -0.589 . . . . 0.0 110.48 179.533 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -57.03 -46.33 82.47 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.419 0.688 . . . . 0.0 111.34 174.402 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.49 -13.03 57.95 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.262 1.025 . . . . 0.0 113.4 175.66 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -123.21 8.54 9.16 Favored 'General case' 0 C--N 1.342 0.26 0 C-N-CA 124.66 1.184 . . . . 0.0 111.959 -173.333 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.3 m 58.23 40.13 25.08 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 119.636 1.107 . . . . 0.0 110.863 179.415 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.26 7.0 m-85 72.19 13.98 5.65 Favored 'General case' 0 N--CA 1.443 -0.796 0 C-N-CA 127.957 2.503 . . . . 0.0 114.499 168.902 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 67.0 mtm -69.93 84.72 0.5 Allowed 'General case' 0 N--CA 1.44 -0.955 0 C-N-CA 125.204 1.402 . . . . 0.0 109.837 170.002 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -53.79 -25.07 17.48 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.502 0.721 . . . . 0.0 111.524 171.105 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.2 m -53.1 -38.64 62.77 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 126.413 1.885 . . . . 0.0 112.631 170.691 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.8 mmtm -72.95 -47.73 42.95 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.267 1.027 . . . . 0.0 108.671 173.454 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.3 m -73.74 3.24 6.76 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 124.797 1.239 . . . . 0.0 113.637 -173.074 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 64.2 mm-40 -54.82 -29.72 55.46 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.2 -0.937 . . . . 0.0 110.542 167.067 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.71 -55.39 35.75 Favored 'General case' 0 C--N 1.345 0.4 0 C-N-CA 125.567 1.547 . . . . 0.0 111.708 172.606 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.5 p -75.81 -29.37 20.14 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 C-N-CA 123.605 0.762 . . . . 0.0 110.16 -173.467 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 59.2 mt -61.04 -46.78 96.0 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 N-CA-C 106.058 -1.83 . . . . 0.0 106.058 168.213 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.81 -26.58 62.18 Favored 'General case' 0 N--CA 1.453 -0.304 0 O-C-N 120.853 -1.155 . . . . 0.0 113.436 172.884 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -76.39 -32.32 58.49 Favored 'General case' 0 N--CA 1.432 -1.33 0 C-N-CA 119.492 -0.883 . . . . 0.0 110.743 175.705 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.8 mt -64.02 -32.83 74.51 Favored 'General case' 0 C--O 1.22 -0.455 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 168.46 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.4 mmt85 -64.71 -57.23 9.55 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 119.913 1.233 . . . . 0.0 109.24 -179.119 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.9 pttp -64.95 -29.64 70.58 Favored 'General case' 0 C--O 1.233 0.186 0 O-C-N 123.543 0.527 . . . . 0.0 111.087 -176.082 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 51.1 t -65.27 -54.19 32.95 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 168.729 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 48.7 t -62.6 -47.07 85.39 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 121.514 -0.741 . . . . 0.0 111.838 -169.921 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.53 -0.89 7.34 Favored 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 124.484 1.114 . . . . 0.0 112.429 -176.728 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.465 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 1.8 tp-100 -77.28 -11.52 59.84 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-N 119.1 0.864 . . . . 0.0 111.572 171.667 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.465 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 54.1 m-85 -141.44 160.64 56.25 Favored Pre-proline 0 N--CA 1.438 -1.053 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -164.23 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -69.82 114.85 3.85 Favored 'Trans proline' 0 N--CA 1.455 -0.758 0 N-CA-C 105.283 -2.622 . . . . 0.0 105.283 165.069 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.43 -29.57 1.14 Allowed 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 117.586 2.439 . . . . 0.0 117.586 -166.577 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -54.1 -17.16 7.16 Favored Glycine 0 CA--C 1.538 1.509 0 CA-C-N 119.601 1.091 . . . . 0.0 114.075 171.852 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.4 ' HG2' ' CG ' ' A' ' 42' ' ' TYR . 8.3 tpm_? -52.16 -29.15 20.81 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 127.589 2.356 . . . . 0.0 112.386 168.017 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.4 t -149.25 139.82 22.55 Favored 'General case' 0 N--CA 1.439 -1.012 0 CA-C-O 122.804 1.288 . . . . 0.0 112.048 -168.277 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.1 t -67.79 -55.03 18.4 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.658 0 CA-C-N 113.747 -1.569 . . . . 0.0 108.704 176.655 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.3 m -61.19 -43.2 95.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 CA-C-O 118.382 -0.818 . . . . 0.0 109.954 -177.106 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 29.5 t -64.57 -32.07 73.56 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.4 1.48 . . . . 0.0 110.18 178.934 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 52.3 m -67.25 -26.93 66.82 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 119.075 -0.488 . . . . 0.0 110.893 171.742 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -71.0 -36.15 64.58 Favored Glycine 0 C--N 1.345 1.05 0 CA-C-O 123.798 1.776 . . . . 0.0 111.092 167.288 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -78.47 -40.3 35.91 Favored 'General case' 0 N--CA 1.412 -2.339 0 N-CA-C 116.293 1.96 . . . . 0.0 116.293 -163.846 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 . . . . . 0 N--CA 1.449 -0.5 0 C-N-CA 119.483 -0.887 . . . . 0.0 110.342 170.858 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 47.3 t0 . . . . . 0 CA--C 1.54 0.584 0 N-CA-C 109.589 -0.522 . . . . 0.0 109.589 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.54 -25.55 29.5 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 123.629 2.886 . . . . 0.0 112.4 -176.14 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 66.0 m -92.66 -11.51 33.93 Favored 'General case' 0 N--CA 1.435 -1.192 0 C-N-CA 124.518 1.127 . . . . 0.0 110.89 -170.699 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 21.4 tp60 -64.34 -25.0 67.84 Favored 'General case' 0 N--CA 1.442 -0.83 0 C-N-CA 123.36 0.664 . . . . 0.0 110.686 179.599 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -62.14 -53.83 49.79 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 123.477 0.711 . . . . 0.0 110.02 169.115 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -62.97 -38.89 92.9 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.043 0.537 . . . . 0.0 109.675 -176.662 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.32 -44.38 72.0 Favored 'General case' 0 C--N 1.342 0.272 0 C-N-CA 125.327 1.451 . . . . 0.0 112.222 169.784 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 85.3 m -58.54 -45.82 88.12 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 117.734 0.243 . . . . 0.0 110.531 173.573 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.0 mm-40 -67.3 -16.63 64.38 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 117.495 -1.24 . . . . 0.0 112.681 -179.864 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 42.2 mm -59.85 -54.3 36.59 Favored 'Isoleucine or valine' 0 C--N 1.34 0.17 0 CA-C-N 121.09 1.768 . . . . 0.0 107.847 169.118 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 50.9 mm-40 -57.27 -52.77 63.98 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.249 -0.887 . . . . 0.0 109.202 174.291 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 18.5 mmmt -65.34 -32.32 73.9 Favored 'General case' 0 C--N 1.334 -0.073 0 C-N-CA 118.741 -1.184 . . . . 0.0 111.757 -172.913 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 17.5 t -57.69 -51.45 69.47 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 169.72 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.65 -47.77 73.13 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.968 0.907 . . . . 0.0 110.876 178.229 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.461 ' HA ' ' CE1' ' A' ' 23' ' ' TYR . 0.6 OUTLIER -55.9 -45.36 78.68 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.024 0.93 . . . . 0.0 111.473 174.07 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.88 -10.99 60.57 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 114.381 1.252 . . . . 0.0 114.381 176.577 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -126.37 16.51 7.7 Favored 'General case' 0 C--N 1.343 0.321 0 CA-C-N 119.806 1.185 . . . . 0.0 113.749 -168.401 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 17.6 m 60.17 34.68 21.1 Favored 'General case' 0 C--N 1.345 0.401 0 CA-C-N 120.523 1.511 . . . . 0.0 110.285 -179.192 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.461 ' CE1' ' HA ' ' A' ' 19' ' ' GLN . 46.4 m-85 67.33 16.43 10.09 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 126.832 2.053 . . . . 0.0 113.719 168.406 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 65.2 mtm -73.7 90.98 1.86 Allowed 'General case' 0 N--CA 1.439 -0.987 0 C-N-CA 126.168 1.787 . . . . 0.0 109.114 175.368 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -54.68 -23.56 17.97 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.982 -0.449 . . . . 0.0 111.469 170.862 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.2 m -53.73 -41.32 66.94 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 126.588 1.955 . . . . 0.0 112.412 170.299 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 61.2 mmtt -71.29 -45.99 61.83 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 124.103 0.961 . . . . 0.0 108.891 173.581 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 86.3 m -73.97 3.47 6.79 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 124.336 1.054 . . . . 0.0 113.012 -172.88 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 79.8 mm-40 -56.45 -27.74 57.66 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.467 -0.771 . . . . 0.0 110.541 166.234 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.31 -60.46 3.78 Favored 'General case' 0 C--N 1.345 0.39 0 C-N-CA 125.403 1.481 . . . . 0.0 111.423 172.003 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.1 p -71.62 -25.92 25.35 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 C-N-CA 123.835 0.854 . . . . 0.0 110.004 -175.093 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 17.0 mt -60.02 -52.46 60.9 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 N-CA-C 106.684 -1.599 . . . . 0.0 106.684 168.101 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.452 ' HA ' ' CG ' ' A' ' 36' ' ' ARG . 31.9 tt0 -55.25 -36.65 66.29 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-O 118.792 -0.623 . . . . 0.0 110.305 178.588 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -65.25 -41.99 93.74 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 118.685 0.675 . . . . 0.0 111.703 176.065 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.538 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 0.7 OUTLIER -61.44 -38.59 87.72 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-O 117.005 -1.474 . . . . 0.0 110.418 173.236 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.452 ' CG ' ' HA ' ' A' ' 33' ' ' GLN 0.275 9.3 ptt85 -70.08 -39.76 75.4 Favored 'General case' 0 C--N 1.341 0.226 0 CA-C-N 120.66 1.573 . . . . 0.0 110.605 -179.865 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.8 mmtp -64.14 -37.1 86.22 Favored 'General case' 0 C--N 1.344 0.34 0 CA-C-N 118.716 0.689 . . . . 0.0 111.188 175.859 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 49.3 t -60.66 -53.18 60.5 Favored 'General case' 0 C--O 1.22 -0.448 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 170.528 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 39' ' ' CYS . . . . . 0.466 ' HA ' HH12 ' A' ' 46' ' ' ARG . 42.3 t -57.56 -44.97 85.64 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 125.306 1.443 . . . . 0.0 113.142 -169.646 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.33 -1.11 25.15 Favored 'General case' 0 N--CA 1.441 -0.902 0 O-C-N 124.67 1.231 . . . . 0.0 112.631 -176.268 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.457 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 3.5 tp-100 -91.86 -1.85 57.13 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 124.23 1.012 . . . . 0.0 112.754 -168.827 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.555 ' HB2' ' CZ ' ' A' ' 46' ' ' ARG . 84.7 m-85 -142.56 165.97 23.66 Favored Pre-proline 0 N--CA 1.443 -0.781 0 C-N-CA 125.985 1.714 . . . . 0.0 110.641 -167.474 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -61.93 139.93 82.21 Favored 'Trans proline' 0 CA--C 1.538 0.68 0 C-N-CA 121.798 1.665 . . . . 0.0 109.433 169.164 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm -71.44 -5.51 33.43 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 114.699 1.37 . . . . 0.0 114.699 -169.186 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -86.86 -12.79 68.01 Favored Glycine 0 CA--C 1.533 1.179 0 CA-C-O 118.636 -1.091 . . . . 0.0 113.669 169.933 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.555 ' CZ ' ' HB2' ' A' ' 42' ' ' TYR . 0.0 OUTLIER -74.39 -9.85 59.0 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.768 1.784 . . . . 0.0 112.757 -173.596 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.407 ' HB2' ' HD2' ' A' ' 46' ' ' ARG . 16.0 t -145.4 146.26 31.48 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 120.909 -1.119 . . . . 0.0 112.053 -174.656 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 23.6 t -84.26 -55.11 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 C-N-CA 126.177 1.791 . . . . 0.0 108.826 173.103 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.8 m -58.22 -41.35 80.75 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 118.212 0.46 . . . . 0.0 110.745 -173.724 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 50' ' ' CYS . . . . . 0.412 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 9.2 t -64.22 -34.48 78.19 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.281 1.433 . . . . 0.0 109.871 -179.928 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.1 p -64.94 -27.16 68.65 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 121.995 -0.44 . . . . 0.0 111.016 174.065 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.09 -45.12 58.01 Favored Glycine 0 C--N 1.348 1.196 0 CA-C-O 123.902 1.834 . . . . 0.0 110.172 168.391 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.538 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.6 OUTLIER -63.73 -39.74 95.04 Favored 'General case' 0 N--CA 1.415 -2.19 0 CA-C-N 111.937 -2.131 . . . . 0.0 115.354 -167.276 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 . . . . . 0 C--N 1.321 -0.667 0 CA-C-O 118.649 -0.691 . . . . 0.0 111.079 178.747 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.9 t0 . . . . . 0 N--CA 1.441 -0.883 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -60.47 -16.63 43.21 Favored 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 124.31 3.34 . . . . 0.0 114.948 -173.65 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 64.2 m -108.57 -6.97 15.82 Favored 'General case' 0 N--CA 1.441 -0.92 0 C-N-CA 127.027 2.131 . . . . 0.0 112.272 -170.465 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 8.0 tp60 -67.89 -22.79 65.07 Favored 'General case' 0 N--CA 1.447 -0.597 0 O-C-N 121.615 -0.678 . . . . 0.0 112.278 -173.018 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 47.5 tptt -67.26 -49.56 63.93 Favored 'General case' 0 C--O 1.226 -0.143 0 CA-C-O 122.028 0.918 . . . . 0.0 109.446 173.456 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 20.4 mp0 -61.64 -43.13 99.44 Favored 'General case' 0 N--CA 1.442 -0.86 0 C-N-CA 127.641 2.377 . . . . 0.0 107.995 -173.962 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -53.78 -41.32 67.1 Favored 'General case' 0 C--N 1.341 0.213 0 C-N-CA 126.562 1.945 . . . . 0.0 114.016 169.797 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.0 m -63.27 -44.84 93.98 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 122.408 0.283 . . . . 0.0 110.263 173.716 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -64.83 -24.88 67.68 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 117.688 -1.148 . . . . 0.0 112.243 179.739 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 37.5 mm -56.54 -50.87 71.36 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.221 0 CA-C-N 120.273 1.397 . . . . 0.0 109.4 169.453 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 45.8 mm-40 -59.97 -56.28 23.68 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 106.971 -1.492 . . . . 0.0 106.971 -175.145 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 44.5 mttt -70.41 -30.19 67.0 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 118.182 -0.913 . . . . 0.0 111.233 -171.618 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 18.9 t -57.26 -47.06 82.37 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 169.185 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.26 -45.75 90.36 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 118.435 -0.793 . . . . 0.0 110.169 179.649 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -58.29 -45.68 87.5 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 119.328 0.967 . . . . 0.0 111.301 174.255 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.93 -13.94 58.53 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 175.862 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -123.86 9.25 8.8 Favored 'General case' 0 C--N 1.343 0.322 0 C-N-CA 124.302 1.041 . . . . 0.0 112.24 -172.928 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.4 m 58.03 40.45 25.39 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 122.404 1.097 . . . . 0.0 110.842 179.369 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.265 6.8 m-85 72.25 14.36 5.53 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 127.801 2.44 . . . . 0.0 114.428 168.79 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 63.0 mtm -69.45 86.27 0.44 Allowed 'General case' 0 N--CA 1.442 -0.843 0 C-N-CA 125.175 1.39 . . . . 0.0 110.329 170.122 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -54.36 -22.97 13.68 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.457 1.103 . . . . 0.0 111.323 169.486 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.6 m -58.02 -40.64 81.35 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 127.027 2.131 . . . . 0.0 112.631 170.085 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.7 mmtm -72.91 -47.73 43.2 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 124.138 0.975 . . . . 0.0 108.561 174.375 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.0 m -70.14 3.33 2.87 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.034 1.334 . . . . 0.0 113.424 -176.791 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 85.1 mm-40 -53.37 -31.7 45.86 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 119.304 0.956 . . . . 0.0 111.122 167.204 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.64 -50.16 74.93 Favored 'General case' 0 C--N 1.344 0.362 0 C-N-CA 125.028 1.331 . . . . 0.0 112.116 174.851 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.7 p -80.91 -29.96 11.66 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.809 0 C-N-CA 123.391 0.677 . . . . 0.0 109.845 -174.256 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.569 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 68.8 mt -63.25 -40.66 89.9 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 169.366 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.67 -34.71 59.61 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 123.727 0.811 . . . . 0.0 112.001 170.232 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -74.85 -42.8 57.25 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 119.806 -0.758 . . . . 0.0 110.846 179.504 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.458 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 2.4 mt -64.23 -30.9 71.94 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 118.276 -0.869 . . . . 0.0 110.311 174.425 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.22 -61.88 2.27 Favored 'General case' 0 CA--C 1.518 -0.269 0 C-N-CA 124.437 1.095 . . . . 0.0 108.756 175.661 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -64.58 -28.12 69.41 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 114.372 -1.286 . . . . 0.0 110.66 -173.499 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 49.4 t -66.28 -55.37 16.41 Favored 'General case' 0 N--CA 1.442 -0.83 0 C-N-CA 123.511 0.724 . . . . 0.0 109.258 168.273 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 47.8 t -60.0 -43.81 94.95 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 123.94 0.896 . . . . 0.0 112.516 -170.859 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.85 -4.32 15.85 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.845 -1.07 . . . . 0.0 113.006 -176.313 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.458 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 3.1 tp-100 -91.7 -4.82 54.67 Favored 'General case' 0 N--CA 1.437 -1.084 0 C-N-CA 125.355 1.462 . . . . 0.0 112.122 -172.6 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.458 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 78.9 m-85 -139.15 161.32 58.3 Favored Pre-proline 0 N--CA 1.446 -0.628 0 C-N-CA 124.132 0.973 . . . . 0.0 112.244 -168.133 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -69.48 98.99 0.69 Allowed 'Trans proline' 0 N--CA 1.456 -0.709 0 N-CA-C 105.096 -2.694 . . . . 0.0 105.096 165.384 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.514 ' H ' ' HD2' ' A' ' 44' ' ' LYS . 2.8 mptp? -39.34 -30.69 0.07 Allowed 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 117.904 2.557 . . . . 0.0 117.904 -165.556 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -54.81 -18.44 11.28 Favored Glycine 0 CA--C 1.541 1.659 0 CA-C-N 120.219 1.372 . . . . 0.0 114.097 170.021 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.0 tpm_? -55.8 -24.04 33.63 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 127.95 2.5 . . . . 0.0 112.053 168.957 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.5 t -144.64 130.16 18.93 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-O 123.387 1.565 . . . . 0.0 112.497 -172.298 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.7 t -69.82 -49.8 54.35 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.758 0 CA-C-N 112.952 -1.931 . . . . 0.0 108.72 176.677 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.4 m -62.58 -42.04 94.38 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-O 118.512 -0.756 . . . . 0.0 110.352 -178.319 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 50' ' ' CYS . . . . . 0.427 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 7.7 t -64.82 -35.28 80.6 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.757 1.623 . . . . 0.0 110.191 176.235 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.3 m -65.44 -28.9 69.56 Favored 'General case' 0 CA--C 1.535 0.398 0 O-C-N 122.082 -0.386 . . . . 0.0 110.525 171.727 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.56 -32.99 71.42 Favored Glycine 0 C--N 1.345 1.052 0 CA-C-O 122.801 1.223 . . . . 0.0 111.366 167.939 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.569 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 0.9 OUTLIER -80.21 -42.08 23.98 Favored 'General case' 0 N--CA 1.422 -1.839 0 N-CA-C 116.103 1.89 . . . . 0.0 116.103 -165.211 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 . . . . . 0 C--N 1.321 -0.632 0 C-N-CA 119.841 -0.744 . . . . 0.0 110.404 171.014 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.2 t0 . . . . . 0 CA--C 1.546 0.815 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -61.52 -30.95 87.23 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 125.247 3.964 . . . . 0.0 113.056 -172.36 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.441 ' HB3' ' CD2' ' A' ' 35' ' ' LEU . 87.9 m -94.16 -15.55 24.53 Favored 'General case' 0 N--CA 1.436 -1.163 0 C-N-CA 125.134 1.374 . . . . 0.0 112.497 -168.552 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 21.7 tp60 -61.15 -24.62 66.42 Favored 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 123.6 0.76 . . . . 0.0 111.181 -179.958 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -63.42 -56.13 18.71 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.48 0.712 . . . . 0.0 110.215 169.018 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -60.6 -37.85 82.75 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.475 0.71 . . . . 0.0 110.389 -176.423 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.41 -39.84 67.7 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 125.48 1.512 . . . . 0.0 113.759 170.039 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.1 m -61.08 -45.18 95.78 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 123.052 0.22 . . . . 0.0 110.445 171.873 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 32.0 mm-40 -63.86 -27.82 69.43 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-O 117.801 -1.095 . . . . 0.0 112.186 179.417 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.414 HD13 HG13 ' A' ' 31' ' ' VAL . 43.1 mm -56.33 -50.62 70.88 Favored 'Isoleucine or valine' 0 C--N 1.341 0.227 0 CA-C-N 120.106 1.321 . . . . 0.0 109.516 170.541 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 47.4 mm-40 -59.13 -56.08 26.75 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 107.218 -1.401 . . . . 0.0 107.218 -175.099 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 24.7 mttm -70.79 -30.67 67.2 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 118.366 -0.826 . . . . 0.0 111.317 -172.15 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 26.0 t -56.86 -46.97 81.44 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 168.571 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.2 -43.99 92.24 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.471 179.877 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.402 HE21 ' HE1' ' A' ' 23' ' ' TYR . 3.1 mp0 -58.17 -46.95 84.84 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 119.434 1.015 . . . . 0.0 111.114 173.378 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.91 -14.8 56.45 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 176.152 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 56.8 m-80 -122.76 10.91 9.67 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.826 1.25 . . . . 0.0 111.439 -173.693 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.9 m 55.5 41.14 31.12 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 122.56 1.171 . . . . 0.0 110.817 177.758 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.402 ' HE1' HE21 ' A' ' 19' ' ' GLN 0.255 6.5 m-85 71.85 12.86 6.15 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 128.544 2.738 . . . . 0.0 114.095 169.816 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 61.3 mtm -72.9 85.71 1.26 Allowed 'General case' 0 N--CA 1.437 -1.121 0 C-N-CA 125.323 1.449 . . . . 0.0 109.166 171.938 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -52.3 -25.66 10.1 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.214 1.006 . . . . 0.0 111.25 169.826 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.2 m -52.65 -36.7 57.24 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 127.145 2.178 . . . . 0.0 113.003 170.501 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 63.1 mttt -83.72 -40.85 18.34 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.588 0.755 . . . . 0.0 109.827 175.064 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 82.9 m -72.04 6.22 2.26 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.475 1.11 . . . . 0.0 113.341 179.433 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 67.7 mm-40 -56.29 -29.18 60.85 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 121.141 -0.974 . . . . 0.0 110.878 167.264 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.97 -55.03 37.7 Favored 'General case' 0 C--N 1.345 0.372 0 C-N-CA 125.285 1.434 . . . . 0.0 111.636 173.799 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.414 HG13 HD13 ' A' ' 14' ' ' ILE . 7.2 p -74.99 -28.75 21.33 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.677 0 C-N-CA 123.549 0.74 . . . . 0.0 109.742 -175.229 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 35.6 mt -61.55 -47.9 91.24 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 168.853 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.452 ' HA ' ' HG2' ' A' ' 36' ' ' ARG . 0.3 OUTLIER -50.76 -40.74 55.61 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 123.597 0.56 . . . . 0.0 110.328 173.456 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -68.64 -39.98 80.49 Favored 'General case' 0 N--CA 1.434 -1.27 0 C-N-CA 119.996 -0.682 . . . . 0.0 111.065 -178.943 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.508 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.3 mt -66.06 -38.94 89.59 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 117.688 -1.149 . . . . 0.0 111.058 174.7 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.452 ' HG2' ' HA ' ' A' ' 33' ' ' GLN . 3.6 ptm180 -67.72 -40.11 84.24 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 120.019 1.281 . . . . 0.0 110.112 179.155 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt -63.22 -42.32 99.24 Favored 'General case' 0 C--N 1.342 0.282 0 C-N-CA 123.131 0.572 . . . . 0.0 110.377 176.191 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 51.8 t -58.04 -51.59 69.04 Favored 'General case' 0 C--O 1.218 -0.589 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 172.298 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.7 t -57.83 -46.09 85.22 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 123.765 0.826 . . . . 0.0 112.069 -173.167 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.67 -0.51 7.02 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.438 -0.801 . . . . 0.0 113.149 -177.782 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.557 ' HB3' ' CE2' ' A' ' 42' ' ' TYR . 17.9 tt0 -83.7 -9.7 58.67 Favored 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 123.722 0.809 . . . . 0.0 111.013 175.799 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.557 ' CE2' ' HB3' ' A' ' 41' ' ' GLN . 80.8 m-85 -139.08 160.4 62.74 Favored Pre-proline 0 N--CA 1.445 -0.724 0 C-N-CA 124.766 1.226 . . . . 0.0 111.725 -167.682 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -68.05 132.47 26.33 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 N-CA-C 105.956 -2.363 . . . . 0.0 105.956 165.758 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -50.27 -42.22 51.85 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.355 1.243 . . . . 0.0 114.355 -167.026 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.78 -11.63 31.03 Favored Glycine 0 CA--C 1.531 1.051 0 CA-C-O 119.081 -0.844 . . . . 0.0 113.555 -178.87 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.61 -19.43 65.77 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 118.916 1.358 . . . . 0.0 112.361 172.471 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.9 t -145.34 136.77 25.13 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-O 122.964 1.364 . . . . 0.0 111.912 -176.929 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.7 t -69.93 -54.24 19.99 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.635 0 CA-C-N 113.697 -1.592 . . . . 0.0 108.701 -179.701 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.6 m -61.34 -38.3 79.61 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 C-N-CA 122.668 0.387 . . . . 0.0 110.232 -179.2 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 50' ' ' CYS . . . . . 0.47 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 11.2 t -66.6 -37.72 85.48 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.726 0.81 . . . . 0.0 109.751 177.354 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.5 m -64.82 -20.96 66.68 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 119.036 -0.507 . . . . 0.0 111.367 173.02 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -80.76 -23.67 59.53 Favored Glycine 0 C--N 1.345 1.031 0 CA-C-N 118.918 0.781 . . . . 0.0 112.3 169.161 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.508 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -80.88 -49.58 10.85 Favored 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 125.052 1.341 . . . . 0.0 114.04 -166.876 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 . . . . . 0 C--N 1.32 -0.684 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.549 176.105 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.1 t0 . . . . . 0 CA--C 1.536 0.418 0 CA-C-O 118.699 -0.667 . . . . 0.0 109.349 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -57.5 -32.72 94.95 Favored 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 124.09 3.193 . . . . 0.0 112.639 -175.594 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 95.3 m -94.23 -11.94 29.22 Favored 'General case' 0 N--CA 1.436 -1.15 0 C-N-CA 125.085 1.354 . . . . 0.0 113.497 -168.899 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 24.6 tp60 -62.5 -27.49 69.18 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 122.767 0.427 . . . . 0.0 110.602 178.224 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.45 -56.99 14.95 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.666 0.786 . . . . 0.0 108.92 169.579 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -64.01 -36.34 83.65 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 121.868 -0.52 . . . . 0.0 110.556 -176.722 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -60.24 -36.75 78.44 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.261 1.025 . . . . 0.0 112.472 172.619 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.6 m -65.72 -41.78 91.85 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 118.062 0.392 . . . . 0.0 111.031 169.248 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -62.61 -27.49 69.24 Favored 'General case' 0 C--O 1.226 -0.159 0 CA-C-O 117.639 -1.172 . . . . 0.0 112.159 177.907 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.413 HD13 HG13 ' A' ' 31' ' ' VAL . 46.2 mm -55.24 -52.37 46.03 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-N 120.098 1.317 . . . . 0.0 109.372 169.895 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 46.9 mm-40 -61.07 -49.75 76.1 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 -173.023 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.4 mtpm? -70.41 -37.37 74.43 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.236 1.014 . . . . 0.0 111.825 -176.015 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 12.9 t -54.27 -43.52 71.06 Favored 'General case' 0 CA--C 1.513 -0.458 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 170.134 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.94 -45.95 89.2 Favored 'General case' 0 N--CA 1.441 -0.909 0 O-C-N 123.57 0.544 . . . . 0.0 109.644 -178.075 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.426 ' HA ' ' CE1' ' A' ' 23' ' ' TYR . 4.3 mm-40 -64.38 -41.75 96.51 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 119.138 0.881 . . . . 0.0 110.604 179.291 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.39 -11.24 14.51 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 171.833 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 55.2 m-80 -127.17 10.45 6.87 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.216 1.406 . . . . 0.0 112.105 -176.567 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 5.4 m 55.1 40.93 32.03 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 122.554 1.168 . . . . 0.0 111.859 -179.904 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.426 ' CE1' ' HA ' ' A' ' 19' ' ' GLN 0.257 7.1 m-85 74.03 13.46 4.08 Favored 'General case' 0 N--CA 1.443 -0.796 0 C-N-CA 128.827 2.851 . . . . 0.0 114.371 168.464 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 67.5 mtm -70.07 84.3 0.52 Allowed 'General case' 0 N--CA 1.441 -0.909 0 C-N-CA 125.063 1.345 . . . . 0.0 109.708 170.248 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -54.26 -24.88 20.52 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.301 0.64 . . . . 0.0 111.499 172.809 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 8.4 t -56.69 -34.93 67.9 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.304 1.042 . . . . 0.0 112.42 172.656 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.9 mmtm -72.99 -46.17 53.76 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.997 0.919 . . . . 0.0 108.527 173.176 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 84.0 m -72.05 1.65 7.02 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 124.363 1.065 . . . . 0.0 113.035 -174.853 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 77.3 mm-40 -57.94 -23.85 55.34 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 120.02 1.282 . . . . 0.0 110.364 166.047 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.58 -56.55 20.76 Favored 'General case' 0 C--N 1.347 0.477 0 C-N-CA 126.043 1.737 . . . . 0.0 111.692 169.5 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.413 HG13 HD13 ' A' ' 14' ' ' ILE . 12.4 p -76.63 -26.23 16.43 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 C-N-CA 123.43 0.692 . . . . 0.0 109.932 -174.932 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.529 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 60.3 mt -61.52 -46.69 96.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 167.829 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.403 ' HA ' ' HG3' ' A' ' 36' ' ' ARG . 0.4 OUTLIER -54.84 -38.98 68.09 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 119.291 0.951 . . . . 0.0 112.285 171.062 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -67.7 -39.43 84.38 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 118.771 0.714 . . . . 0.0 110.478 178.796 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.568 HD13 ' CE1' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -66.55 -27.08 67.47 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 124.932 1.293 . . . . 0.0 109.003 175.918 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.403 ' HG3' ' HA ' ' A' ' 33' ' ' GLN . 7.9 mmt-85 -70.79 -48.79 52.39 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 176.315 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 28.1 mmtp -60.91 -31.24 70.76 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 123.575 0.547 . . . . 0.0 111.363 177.834 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 43.1 t -67.06 -58.79 4.24 Favored 'General case' 0 N--CA 1.44 -0.964 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 168.455 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 38.8 t -61.52 -39.58 91.54 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 121.115 -0.991 . . . . 0.0 113.17 -169.173 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.47 -2.02 12.62 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 -175.605 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.563 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 12.1 tt0 -94.63 -7.21 41.54 Favored 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 127.43 2.292 . . . . 0.0 111.448 -171.086 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.563 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 78.4 m-85 -138.77 161.18 59.78 Favored Pre-proline 0 N--CA 1.447 -0.602 0 C-N-CA 124.445 1.098 . . . . 0.0 112.063 -167.877 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -67.79 121.03 8.05 Favored 'Trans proline' 0 N--CA 1.456 -0.713 0 N-CA-C 104.792 -2.811 . . . . 0.0 104.792 164.436 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.9 mmtt -51.35 -33.06 27.94 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 -166.025 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.88 -14.89 32.62 Favored Glycine 0 CA--C 1.533 1.18 0 C-N-CA 124.334 0.969 . . . . 0.0 113.913 176.313 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.9 tpm_? -57.12 -31.45 65.32 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 125.32 1.448 . . . . 0.0 111.247 169.446 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.6 t -136.64 134.8 37.71 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-O 123.372 1.558 . . . . 0.0 112.62 -168.781 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 15.6 t -68.91 -54.04 22.78 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.699 0 CA-C-N 112.789 -2.005 . . . . 0.0 108.425 177.044 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 5.1 m -60.72 -43.5 95.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.47 0 CA-C-O 118.241 -0.885 . . . . 0.0 109.814 -177.969 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 43.4 t -63.11 -32.05 73.34 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.427 1.491 . . . . 0.0 110.284 179.949 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.2 m -68.81 -27.72 66.11 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.059 0.544 . . . . 0.0 111.079 172.108 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.99 -35.17 78.22 Favored Glycine 0 C--N 1.345 1.031 0 CA-C-O 123.794 1.774 . . . . 0.0 111.525 167.357 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.568 ' CE1' HD13 ' A' ' 35' ' ' LEU . 1.5 t80 -80.78 -40.34 25.27 Favored 'General case' 0 N--CA 1.415 -2.216 0 N-CA-C 117.162 2.282 . . . . 0.0 117.162 -162.687 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 . . . . . 0 C--N 1.321 -0.634 0 CA-C-O 118.64 -0.695 . . . . 0.0 110.337 169.527 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.0 t0 . . . . . 0 N--CA 1.445 -0.723 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -59.04 -18.3 42.6 Favored 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 124.827 3.685 . . . . 0.0 115.053 -172.354 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 65.5 m -110.55 -8.49 14.63 Favored 'General case' 0 N--CA 1.438 -1.069 0 C-N-CA 126.888 2.075 . . . . 0.0 113.206 -168.473 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 18.5 tp60 -66.54 -23.97 66.3 Favored 'General case' 0 N--CA 1.445 -0.717 0 O-C-N 121.916 -0.49 . . . . 0.0 111.987 -173.258 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -69.07 -45.09 71.21 Favored 'General case' 0 C--O 1.225 -0.191 0 CA-C-O 121.827 0.822 . . . . 0.0 110.069 174.433 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.9 mp0 -65.74 -40.75 92.44 Favored 'General case' 0 N--CA 1.443 -0.807 0 C-N-CA 127.317 2.247 . . . . 0.0 108.098 -175.318 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.66 -44.43 73.28 Favored 'General case' 0 C--N 1.341 0.225 0 C-N-CA 125.474 1.51 . . . . 0.0 112.504 168.556 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 70.9 m -59.27 -43.87 92.47 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 110.424 -0.213 . . . . 0.0 110.424 175.399 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -63.96 -21.02 66.3 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 117.584 -1.198 . . . . 0.0 112.518 178.73 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 26.3 mm -59.75 -54.97 27.22 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.193 0 CA-C-N 120.587 1.54 . . . . 0.0 108.942 171.788 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -57.61 -54.25 49.03 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 115.163 -0.926 . . . . 0.0 108.848 178.343 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 57.2 mmtt -68.57 -30.64 69.45 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 118.567 -1.253 . . . . 0.0 111.592 -172.757 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 19.9 t -56.82 -48.85 77.05 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 168.789 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.76 -46.81 84.01 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 123.099 0.56 . . . . 0.0 110.477 179.55 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -57.22 -45.96 83.37 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.708 0.803 . . . . 0.0 111.267 174.204 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.85 -12.78 57.03 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 175.387 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -124.21 8.6 8.54 Favored 'General case' 0 C--N 1.342 0.264 0 C-N-CA 124.592 1.157 . . . . 0.0 112.29 -172.524 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 58.6 40.1 23.96 Favored 'General case' 0 C--N 1.345 0.389 0 CA-C-O 122.414 1.102 . . . . 0.0 110.846 179.42 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.264 7.1 m-85 72.09 13.88 5.77 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 127.849 2.459 . . . . 0.0 114.612 168.72 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 66.0 mtm -69.83 85.84 0.5 Allowed 'General case' 0 N--CA 1.441 -0.91 0 C-N-CA 125.063 1.345 . . . . 0.0 110.107 170.148 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -53.9 -24.47 16.24 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.505 0.722 . . . . 0.0 111.698 170.643 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.1 m -53.65 -40.56 65.97 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 126.299 1.839 . . . . 0.0 112.335 170.631 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.4 mmtm -71.85 -47.28 54.15 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 124.201 1.0 . . . . 0.0 108.754 174.132 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 70.9 m -74.22 4.29 5.93 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 124.78 1.232 . . . . 0.0 113.418 -173.626 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 59.4 mm-40 -54.9 -32.29 60.89 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 119.131 0.878 . . . . 0.0 109.894 166.846 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.96 -53.0 63.0 Favored 'General case' 0 C--N 1.345 0.39 0 C-N-CA 124.582 1.153 . . . . 0.0 111.676 174.709 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.7 p -77.54 -27.15 15.46 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.78 0 C-N-CA 123.439 0.696 . . . . 0.0 110.027 -174.296 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.529 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 53.7 mt -63.18 -44.03 99.13 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 168.581 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -57.92 -29.74 65.37 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 118.966 0.803 . . . . 0.0 111.768 173.193 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -70.17 -47.5 61.34 Favored 'General case' 0 N--CA 1.443 -0.822 0 CA-C-N 118.69 0.677 . . . . 0.0 111.557 173.458 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.471 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.7 mt -61.9 -31.6 71.91 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 118.958 0.799 . . . . 0.0 110.239 176.759 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.73 -59.72 4.96 Favored 'General case' 0 CA--C 1.52 -0.208 0 C-N-CA 125.948 1.699 . . . . 0.0 109.956 175.2 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -63.47 -34.79 78.55 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 114.715 -1.13 . . . . 0.0 110.922 -177.256 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 42.8 t -62.22 -51.64 66.97 Favored 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 169.726 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 52.5 t -64.36 -48.73 74.41 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 123.7 0.8 . . . . 0.0 112.003 -170.173 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.85 -1.3 5.28 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 124.216 1.006 . . . . 0.0 112.339 -175.707 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.488 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 2.2 tp-100 -81.32 -8.22 59.71 Favored 'General case' 0 N--CA 1.437 -1.085 0 C-N-CA 125.005 1.322 . . . . 0.0 111.288 175.033 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.488 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 82.0 m-85 -142.04 160.4 55.52 Favored Pre-proline 0 N--CA 1.443 -0.818 0 C-N-CA 125.015 1.326 . . . . 0.0 111.907 -167.438 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -69.37 124.95 11.76 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 N-CA-C 105.641 -2.484 . . . . 0.0 105.641 165.234 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -47.11 -35.75 7.5 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 116.205 1.928 . . . . 0.0 116.205 -166.947 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.9 -14.56 17.06 Favored Glycine 0 CA--C 1.534 1.265 0 C-N-CA 124.515 1.055 . . . . 0.0 114.051 177.946 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 9.0 tpm_? -54.83 -28.46 49.82 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 126.401 1.88 . . . . 0.0 112.348 168.62 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.0 t -149.69 140.37 22.61 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-O 122.623 1.202 . . . . 0.0 111.531 -168.968 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 10.5 t -69.47 -54.24 20.67 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.691 0 CA-C-N 114.019 -1.446 . . . . 0.0 108.617 178.028 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.5 m -61.07 -40.49 85.85 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 C-N-CA 122.916 0.486 . . . . 0.0 110.334 -177.542 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 50' ' ' CYS . . . . . 0.475 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 12.6 t -67.1 -36.04 81.07 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.716 1.206 . . . . 0.0 109.905 177.473 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 53.3 m -65.51 -27.59 68.58 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 121.773 -0.579 . . . . 0.0 110.873 172.476 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -71.14 -27.91 71.12 Favored Glycine 0 C--N 1.345 1.047 0 CA-C-O 122.125 0.847 . . . . 0.0 112.06 169.425 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.529 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 0.2 OUTLIER -80.95 -47.66 13.37 Favored 'General case' 0 N--CA 1.428 -1.574 0 C-N-CA 125.727 1.611 . . . . 0.0 114.801 -166.965 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 . . . . . 0 CA--C 1.54 0.593 0 C-N-CA 119.517 -0.873 . . . . 0.0 110.152 173.626 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 36.6 t0 . . . . . 0 CA--C 1.537 0.464 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_exo -60.57 -31.34 92.18 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 123.599 2.866 . . . . 0.0 112.781 -171.809 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.414 ' HB3' ' CD2' ' A' ' 35' ' ' LEU . 77.7 m -94.25 -13.17 26.82 Favored 'General case' 0 N--CA 1.438 -1.069 0 C-N-CA 125.194 1.398 . . . . 0.0 112.558 -169.45 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.0 tp60 -61.7 -25.23 67.29 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 123.131 0.572 . . . . 0.0 110.855 177.804 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.8 tttm -60.14 -56.58 19.83 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.824 1.25 . . . . 0.0 109.962 168.118 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -62.99 -36.97 85.3 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.355 0.662 . . . . 0.0 110.568 -177.992 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.63 -43.95 72.75 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 124.854 1.262 . . . . 0.0 112.214 169.388 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 80.8 m -57.93 -43.5 86.32 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 121.174 -0.21 . . . . 0.0 110.965 172.96 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -63.61 -23.56 67.43 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-O 117.751 -1.119 . . . . 0.0 112.491 178.728 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 26.4 mm -59.36 -54.72 30.39 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.226 0 CA-C-N 120.128 1.331 . . . . 0.0 108.833 172.531 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 33.0 mm-40 -59.2 -53.07 62.49 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.422 179.467 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.34 -33.08 74.93 Favored 'General case' 0 C--N 1.333 -0.111 0 C-N-CA 118.703 -1.199 . . . . 0.0 111.568 -175.811 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 23.6 t -56.1 -47.68 77.59 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 119.271 0.941 . . . . 0.0 108.944 169.329 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.07 -46.83 84.78 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 123.516 0.727 . . . . 0.0 110.682 178.8 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -57.4 -43.83 84.05 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.72 0.808 . . . . 0.0 111.305 173.782 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.5 -11.96 59.19 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.076 0.95 . . . . 0.0 113.477 174.631 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 -125.66 8.63 7.62 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 124.719 1.208 . . . . 0.0 112.358 -172.029 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.1 m 58.56 40.17 24.0 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-N 119.494 1.043 . . . . 0.0 110.903 179.78 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.257 6.9 m-85 71.71 13.34 6.24 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 127.654 2.382 . . . . 0.0 114.779 168.614 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 64.4 mtm -70.17 84.61 0.54 Allowed 'General case' 0 N--CA 1.441 -0.892 0 C-N-CA 125.184 1.394 . . . . 0.0 109.722 170.082 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -54.63 -24.27 20.78 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 119.063 -0.494 . . . . 0.0 111.637 172.335 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.8 m -51.77 -44.05 63.22 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 126.452 1.901 . . . . 0.0 112.141 170.076 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.4 mmtm -67.75 -48.49 66.26 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 124.175 0.99 . . . . 0.0 108.687 174.651 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.422 ' O ' HG12 ' A' ' 31' ' ' VAL . 73.2 m -72.73 2.71 6.1 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 124.973 1.309 . . . . 0.0 113.302 -174.748 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 45.9 mm-40 -56.3 -26.64 52.82 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 120.078 1.308 . . . . 0.0 111.281 168.159 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.34 -51.38 69.64 Favored 'General case' 0 C--N 1.345 0.392 0 C-N-CA 125.537 1.535 . . . . 0.0 112.184 169.951 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.422 HG12 ' O ' ' A' ' 28' ' ' CYS . 9.7 p -80.71 -26.09 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.888 0 C-N-CA 123.698 0.799 . . . . 0.0 109.657 -174.759 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.5 mp -60.51 -48.52 88.15 Favored 'Isoleucine or valine' 0 C--N 1.35 0.593 0 N-CA-C 105.689 -1.967 . . . . 0.0 105.689 166.214 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.454 ' HA ' ' HG2' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -52.98 -37.63 61.48 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 123.212 0.605 . . . . 0.0 110.886 176.514 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -70.91 -39.49 72.69 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 120.072 -0.651 . . . . 0.0 110.974 179.669 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.549 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.0 OUTLIER -64.4 -36.83 85.41 Favored 'General case' 0 C--N 1.342 0.279 0 CA-C-O 117.877 -1.059 . . . . 0.0 110.765 174.663 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.454 ' HG2' ' HA ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -68.12 -40.5 82.51 Favored 'General case' 0 C--N 1.341 0.219 0 CA-C-N 119.775 1.17 . . . . 0.0 110.215 178.347 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 57.2 mttp -63.49 -39.55 94.73 Favored 'General case' 0 C--N 1.341 0.218 0 CA-C-O 119.232 -0.413 . . . . 0.0 111.012 175.536 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.1 t -59.33 -52.74 64.34 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 171.937 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.1 t -57.74 -48.87 78.4 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 124.034 0.934 . . . . 0.0 112.048 -171.663 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.12 -1.25 7.26 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.241 -0.89 . . . . 0.0 112.722 -175.148 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.539 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 21.2 tt0 -84.15 -12.09 55.52 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 125.203 1.401 . . . . 0.0 111.345 179.088 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.539 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 76.4 m-85 -133.02 157.87 77.26 Favored Pre-proline 0 N--CA 1.447 -0.617 0 C-N-CA 124.174 0.99 . . . . 0.0 112.003 -168.146 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -67.31 109.43 1.78 Allowed 'Trans proline' 0 N--CA 1.453 -0.898 0 N-CA-C 104.878 -2.778 . . . . 0.0 104.878 165.501 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.88 -27.48 0.53 Allowed 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 117.199 2.296 . . . . 0.0 117.199 -166.773 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.47 -18.44 29.92 Favored Glycine 0 CA--C 1.536 1.369 0 CA-C-N 119.512 1.051 . . . . 0.0 113.571 172.479 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.26 -21.19 63.67 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.946 2.098 . . . . 0.0 112.516 170.93 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.6 t -148.06 134.59 19.75 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 123.566 1.651 . . . . 0.0 114.152 -170.434 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.8 t -72.43 -55.33 13.52 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.638 0 CA-C-N 112.552 -2.113 . . . . 0.0 108.886 178.017 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 5.9 m -59.2 -40.88 82.21 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 C-N-CA 122.684 0.394 . . . . 0.0 110.029 -179.178 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 50' ' ' CYS . . . . . 0.452 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 13.3 t -63.78 -37.57 87.88 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.524 1.13 . . . . 0.0 109.713 178.021 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 52.7 m -67.64 -17.11 64.49 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 118.727 -0.654 . . . . 0.0 112.319 175.035 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -86.04 -20.57 55.1 Favored Glycine 0 C--N 1.344 0.991 0 CA-C-N 119.148 0.886 . . . . 0.0 112.205 167.776 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.549 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -80.21 -43.13 22.0 Favored 'General case' 0 N--CA 1.418 -2.052 0 N-CA-C 113.959 1.096 . . . . 0.0 113.959 -166.269 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 . . . . . 0 C--N 1.319 -0.752 0 O-C-N 123.975 0.797 . . . . 0.0 110.68 179.916 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 46.1 t0 . . . . . 0 CA--C 1.539 0.524 0 CA-C-O 119.183 -0.437 . . . . 0.0 111.814 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -63.85 -28.42 67.51 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 123.646 2.897 . . . . 0.0 112.671 -175.509 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 13.1 m -91.44 -8.1 48.75 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 123.418 0.687 . . . . 0.0 112.145 -176.927 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 20.1 tp60 -63.48 -25.04 68.08 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 119.13 0.877 . . . . 0.0 110.527 -179.514 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -60.04 -52.32 65.89 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.506 1.122 . . . . 0.0 109.589 169.454 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -65.37 -38.71 90.89 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.616 -0.678 . . . . 0.0 110.244 -179.442 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -59.97 -35.4 74.92 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.136 0.974 . . . . 0.0 112.522 172.329 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 95.6 m -65.13 -43.55 91.55 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.229 0.468 . . . . 0.0 110.936 169.207 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 -62.75 -25.54 68.25 Favored 'General case' 0 C--O 1.225 -0.232 0 CA-C-O 117.725 -1.131 . . . . 0.0 112.221 178.367 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 45.2 mm -56.72 -50.3 74.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-N 120.187 1.358 . . . . 0.0 109.439 169.56 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 44.9 mm-40 -60.68 -54.32 46.74 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 -175.729 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 27.0 mttm -70.53 -30.92 67.8 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 118.56 -0.733 . . . . 0.0 111.623 -173.29 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 21.5 t -56.98 -46.0 82.52 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 107.934 -1.136 . . . . 0.0 107.934 168.666 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.0 -43.9 91.58 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-O 118.297 -0.859 . . . . 0.0 110.372 179.722 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -58.51 -46.51 86.6 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 119.475 1.034 . . . . 0.0 111.129 173.07 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.42 -15.28 60.3 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 175.953 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.3 m-80 -122.81 11.05 9.65 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.925 1.29 . . . . 0.0 111.43 -172.931 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.9 m 55.98 40.74 30.36 Favored 'General case' 0 C--N 1.346 0.44 0 CA-C-O 122.556 1.17 . . . . 0.0 110.817 177.315 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.253 6.7 m-85 71.85 12.59 6.17 Favored 'General case' 0 N--CA 1.444 -0.758 0 C-N-CA 128.466 2.706 . . . . 0.0 114.068 169.713 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 62.0 mtm -73.26 83.99 1.38 Allowed 'General case' 0 N--CA 1.437 -1.123 0 C-N-CA 125.445 1.498 . . . . 0.0 109.159 172.214 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -53.46 -24.01 11.68 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.022 0.929 . . . . 0.0 111.465 172.115 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.1 m -51.88 -41.29 61.78 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 126.131 1.773 . . . . 0.0 112.307 169.988 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 56.8 mttt -76.69 -42.5 41.35 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.234 0.614 . . . . 0.0 109.753 175.779 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.8 m -70.98 0.73 6.79 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 124.193 0.997 . . . . 0.0 113.275 -178.7 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 82.3 mm-40 -55.25 -27.44 46.44 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 119.935 1.243 . . . . 0.0 110.823 167.114 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.07 -60.57 3.54 Favored 'General case' 0 C--N 1.345 0.401 0 C-N-CA 125.637 1.575 . . . . 0.0 111.467 171.46 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.6 p -70.93 -29.46 37.38 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.694 0 C-N-CA 123.635 0.774 . . . . 0.0 109.979 -174.437 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.518 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 70.3 mt -58.63 -52.7 56.66 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 N-CA-C 105.869 -1.9 . . . . 0.0 105.869 168.842 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -58.79 -30.07 67.3 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 119.48 1.036 . . . . 0.0 113.187 175.921 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -71.27 -37.67 71.89 Favored 'General case' 0 N--CA 1.438 -1.072 0 C-N-CA 119.833 -0.747 . . . . 0.0 109.724 176.62 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.517 HD13 ' CE1' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -63.42 -30.74 71.82 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 124.811 1.244 . . . . 0.0 108.916 172.289 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.2 mmt85 -70.35 -49.58 47.84 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 -179.952 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 46.1 mttp -61.71 -36.57 81.29 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 124.257 1.023 . . . . 0.0 111.156 177.13 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 42.7 t -60.45 -54.04 50.27 Favored 'General case' 0 C--O 1.221 -0.429 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 169.357 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 51.5 t -61.49 -44.27 97.39 Favored 'General case' 0 CA--C 1.515 -0.379 0 C-N-CA 124.477 1.111 . . . . 0.0 112.202 -169.6 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.45 -3.14 16.31 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.18 -0.918 . . . . 0.0 113.112 -178.354 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.444 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 2.5 tp-100 -88.63 -2.48 58.62 Favored 'General case' 0 N--CA 1.439 -0.999 0 C-N-CA 124.219 1.008 . . . . 0.0 111.361 -175.783 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.444 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 63.2 m-85 -143.13 162.88 40.83 Favored Pre-proline 0 N--CA 1.443 -0.804 0 C-N-CA 127.364 2.266 . . . . 0.0 110.795 -168.882 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_exo -61.33 116.97 3.74 Favored 'Trans proline' 0 N--CA 1.456 -0.699 0 N-CA-C 105.706 -2.459 . . . . 0.0 105.706 166.231 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -51.84 -35.36 44.31 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 120.498 1.499 . . . . 0.0 114.655 -168.929 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -70.26 -4.61 51.13 Favored Glycine 0 CA--C 1.531 1.089 0 CA-C-O 118.258 -1.301 . . . . 0.0 114.143 178.395 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.97 -7.18 32.78 Favored 'General case' 0 CA--C 1.554 1.104 0 CA-C-N 120.044 1.922 . . . . 0.0 111.86 174.508 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.7 t -141.17 155.32 46.09 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 126.162 1.785 . . . . 0.0 110.404 -168.392 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 47.9 t -79.2 -60.92 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.562 0 C-N-CA 124.876 1.27 . . . . 0.0 108.801 171.197 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.5 m -60.37 -44.31 95.71 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 CA-C-O 119.073 -0.489 . . . . 0.0 110.044 -169.631 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 31.7 t -65.64 -29.39 69.96 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.177 1.391 . . . . 0.0 110.23 -179.737 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 69.6 m -69.68 -21.62 63.5 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 118.533 -0.746 . . . . 0.0 111.307 171.796 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -75.51 -39.23 35.82 Favored Glycine 0 C--N 1.344 1.009 0 CA-C-O 124.474 2.152 . . . . 0.0 110.681 166.976 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.518 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 1.1 t80 -76.69 -38.73 53.94 Favored 'General case' 0 N--CA 1.419 -1.998 0 CA-C-N 111.819 -2.19 . . . . 0.0 116.705 -163.721 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 . . . . . 0 C--N 1.322 -0.6 0 CA-C-O 118.643 -0.694 . . . . 0.0 110.954 169.731 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.5 mtt . . . . . 0 CA--C 1.54 0.584 0 N-CA-C 111.705 0.261 . . . . 0.0 111.705 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -76.45 60.47 6.48 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 123.961 3.107 . . . . 0.0 109.491 169.298 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 30.8 mm-40 -143.75 -176.26 4.91 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 129.125 2.97 . . . . 0.0 107.856 -174.304 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -57.52 114.28 2.16 Favored 'General case' 0 C--N 1.341 0.235 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 169.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 36.0 t0 -95.13 105.92 22.53 Favored Pre-proline 0 N--CA 1.446 -0.647 0 C-N-CA 127.428 2.291 . . . . 0.0 107.776 -176.261 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -55.91 -33.93 90.28 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 124.499 3.466 . . . . 0.0 113.068 -175.585 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.408 ' HB3' ' CD2' ' A' ' 35' ' ' LEU . 56.8 m -94.92 -13.2 25.61 Favored 'General case' 0 N--CA 1.435 -1.217 0 C-N-CA 125.815 1.646 . . . . 0.0 113.054 -169.165 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.6 tp60 -62.64 -25.94 68.37 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.695 0.68 . . . . 0.0 111.416 -177.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -61.21 -50.44 73.07 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.376 0.67 . . . . 0.0 110.195 172.387 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -64.47 -44.59 90.56 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 123.777 0.831 . . . . 0.0 109.149 179.268 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.59 -41.53 54.74 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 119.937 1.244 . . . . 0.0 113.035 174.38 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 84.6 m -56.56 -46.7 80.58 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 123.419 0.449 . . . . 0.0 110.128 174.053 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -60.28 -39.04 85.48 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 117.496 -1.24 . . . . 0.0 112.303 177.116 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 2.0 mp -59.16 -49.87 81.82 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 CA-C-N 120.451 1.478 . . . . 0.0 109.482 173.281 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 93.8 mm-40 -61.34 -51.35 69.18 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 -174.315 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 41.2 mtpt -68.89 -37.98 79.34 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 123.798 0.839 . . . . 0.0 111.945 -177.319 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 17.2 t -52.28 -46.45 65.87 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 169.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.57 -46.39 84.02 Favored 'General case' 0 N--CA 1.442 -0.856 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 -177.075 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.435 ' HA ' ' CE1' ' A' ' 23' ' ' TYR . 3.1 mm-40 -63.15 -44.2 96.2 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 118.999 0.818 . . . . 0.0 110.637 179.265 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -60.95 -14.11 20.49 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 113.193 0.812 . . . . 0.0 113.193 172.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 57.9 m-80 -122.34 11.51 10.04 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.59 1.556 . . . . 0.0 111.123 -177.415 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 12.6 m 51.6 43.31 29.86 Favored 'General case' 0 C--N 1.346 0.447 0 C-N-CA 125.026 1.33 . . . . 0.0 112.011 -179.256 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.435 ' CE1' ' HA ' ' A' ' 19' ' ' GLN 0.271 7.4 m-85 73.49 14.26 4.38 Favored 'General case' 0 N--CA 1.441 -0.891 0 C-N-CA 129.14 2.976 . . . . 0.0 113.976 169.145 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 64.7 mtm -69.88 85.03 0.49 Allowed 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 125.37 1.468 . . . . 0.0 110.351 170.057 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -55.33 -17.6 5.04 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 127.115 2.166 . . . . 0.0 111.179 168.557 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 68.8 m -60.75 -54.06 49.86 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.76 1.624 . . . . 0.0 110.346 168.136 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 57.6 mttt -67.3 -43.29 82.07 Favored 'General case' 0 C--O 1.231 0.128 0 O-C-N 121.799 -0.563 . . . . 0.0 109.846 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.5 m -71.09 2.69 4.19 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 117.234 -1.365 . . . . 0.0 113.164 175.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 59.0 mm-40 -53.6 -34.24 57.73 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 121.022 1.737 . . . . 0.0 111.432 169.728 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.08 -56.42 22.49 Favored 'General case' 0 C--N 1.342 0.271 0 CA-C-N 119.271 0.941 . . . . 0.0 111.308 177.711 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.9 p -73.21 -33.22 40.99 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.025 -174.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 35.9 mt -59.25 -44.05 91.18 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.467 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 170.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.54 -34.71 62.24 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 118.332 0.515 . . . . 0.0 111.172 173.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -72.09 -40.17 68.41 Favored 'General case' 0 N--CA 1.427 -1.581 0 C-N-CA 118.536 -1.266 . . . . 0.0 111.158 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.492 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.5 mt -65.01 -30.5 71.49 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 119.903 1.229 . . . . 0.0 111.75 173.55 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.95 -58.23 9.46 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 124.053 0.941 . . . . 0.0 108.879 174.735 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.48 -35.62 76.34 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 114.15 -1.386 . . . . 0.0 111.11 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 49.6 t -62.27 -50.11 72.99 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 123.52 0.728 . . . . 0.0 109.288 172.069 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 53.1 t -64.05 -48.07 77.72 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 123.905 0.882 . . . . 0.0 111.671 -172.242 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.408 ' HA ' ' HE3' ' A' ' 44' ' ' LYS . . . -67.45 -2.98 7.21 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 124.434 1.093 . . . . 0.0 112.706 -178.167 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.444 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 2.6 tp-100 -83.5 -5.87 59.29 Favored 'General case' 0 N--CA 1.439 -1.015 0 C-N-CA 124.87 1.268 . . . . 0.0 111.414 179.096 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.444 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 82.6 m-85 -138.81 161.83 56.15 Favored Pre-proline 0 N--CA 1.444 -0.767 0 C-N-CA 125.415 1.486 . . . . 0.0 110.508 -169.045 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -67.73 107.95 1.56 Allowed 'Trans proline' 0 N--CA 1.457 -0.664 0 N-CA-C 104.518 -2.916 . . . . 0.0 104.518 165.407 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.408 ' HE3' ' HA ' ' A' ' 40' ' ' ALA . 31.6 mmtm -38.08 -43.29 0.73 Allowed 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 117.04 2.237 . . . . 0.0 117.04 -163.918 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.19 -14.33 11.54 Favored Glycine 0 CA--C 1.537 1.429 0 C-N-CA 124.475 1.036 . . . . 0.0 114.109 177.137 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 29.1 tpt85 -48.83 -34.11 11.81 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 128.285 2.634 . . . . 0.0 112.168 170.306 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.3 t -138.78 140.86 38.76 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-O 121.939 0.876 . . . . 0.0 110.301 -169.132 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 11.8 t -69.52 -53.29 25.52 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 CA-C-N 114.413 -1.267 . . . . 0.0 108.823 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 5.0 m -61.88 -38.9 81.71 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 CA-C-O 119.297 -0.382 . . . . 0.0 110.248 -178.012 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' CYS . . . . . 0.474 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 10.2 t -66.27 -38.31 87.51 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.915 0.886 . . . . 0.0 109.799 176.935 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.4 m -65.24 -21.07 66.69 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 118.803 -0.618 . . . . 0.0 111.309 173.339 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -79.01 -25.97 58.95 Favored Glycine 0 C--N 1.343 0.958 0 CA-C-O 122.173 0.874 . . . . 0.0 112.34 168.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.492 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -80.41 -44.85 18.65 Favored 'General case' 0 N--CA 1.429 -1.503 0 N-CA-C 114.85 1.426 . . . . 0.0 114.85 -165.642 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -64.19 -24.12 67.56 Favored 'General case' 0 C--N 1.319 -0.744 0 O-C-N 123.546 0.528 . . . . 0.0 110.425 173.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -73.43 -43.27 60.75 Favored 'General case' 0 C--N 1.346 0.422 0 O-C-N 121.398 -0.814 . . . . 0.0 110.217 168.186 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.45 -40.94 88.44 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.547 0.739 . . . . 0.0 110.901 175.06 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -59.79 -49.26 78.42 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 125.383 1.473 . . . . 0.0 109.257 175.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -56.3 -47.74 78.06 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-O 118.068 -0.968 . . . . 0.0 110.027 172.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -55.05 -48.4 73.5 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 119.308 0.958 . . . . 0.0 110.851 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -66.32 -30.53 70.96 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.009 0.924 . . . . 0.0 111.371 -178.559 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 39.5 mt -78.22 -42.47 31.21 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.823 1.249 . . . . 0.0 109.065 -179.314 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -56.84 -42.64 80.02 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.887 1.675 . . . . 0.0 109.95 169.117 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 39.6 ttp180 -70.48 -17.38 62.97 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.95 1.3 . . . . 0.0 112.256 176.328 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 55.19 24.94 6.72 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 128.203 2.601 . . . . 0.0 113.22 169.624 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 64.0 p -168.08 160.86 12.23 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 123.777 0.831 . . . . 0.0 110.531 -169.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -78.5 27.63 0.21 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.216 1.407 . . . . 0.0 112.512 169.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 43.1 m -64.08 177.9 0.74 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.758 1.623 . . . . 0.0 111.07 175.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 64.5 tttm . . . . . 0 C--N 1.343 0.313 0 C-N-CA 124.057 0.943 . . . . 0.0 108.994 -170.098 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.3 ptm . . . . . 0 N--CA 1.445 -0.711 0 CA-C-O 118.375 -0.821 . . . . 0.0 108.904 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -67.08 110.41 1.96 Allowed 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 122.41 2.073 . . . . 0.0 108.411 168.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -74.59 172.33 12.23 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.107 0.963 . . . . 0.0 110.059 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 43.9 tttm -68.78 30.79 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.529 1.932 . . . . 0.0 112.515 171.107 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 27.2 t0 -97.73 103.71 17.99 Favored Pre-proline 0 N--CA 1.444 -0.744 0 C-N-CA 128.361 2.664 . . . . 0.0 109.245 -171.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -55.94 -29.44 73.23 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 123.68 2.92 . . . . 0.0 113.572 -176.535 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 99.1 m -102.27 -8.78 20.97 Favored 'General case' 0 N--CA 1.438 -1.057 0 C-N-CA 125.857 1.663 . . . . 0.0 113.974 -168.408 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.1 tt0 -62.96 -26.0 68.63 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 123.454 0.702 . . . . 0.0 111.327 -179.212 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.9 tmtt? -61.34 -53.23 59.34 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.45 1.1 . . . . 0.0 109.977 169.592 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -63.61 -43.96 95.38 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.714 0.806 . . . . 0.0 109.866 -178.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -51.05 -42.03 60.26 Favored 'General case' 0 C--N 1.341 0.217 0 C-N-CA 125.227 1.411 . . . . 0.0 112.773 169.413 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 79.7 m -63.23 -43.53 97.82 Favored 'General case' 0 C--O 1.234 0.239 0 O-C-N 123.166 0.291 . . . . 0.0 111.114 174.577 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 57.1 mm-40 -59.52 -32.93 70.75 Favored 'General case' 0 C--N 1.342 0.28 0 CA-C-O 118.325 -0.845 . . . . 0.0 111.529 177.421 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.626 HD13 HG22 ' A' ' 31' ' ' VAL . 10.6 mm -58.42 -44.63 89.12 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.143 0 CA-C-N 119.519 1.054 . . . . 0.0 110.561 174.868 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 63.8 mm-40 -64.68 -51.13 64.11 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 -169.468 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.0 tmtt? -67.52 -39.54 85.1 Favored 'General case' 0 N--CA 1.442 -0.862 0 C-N-CA 127.536 2.334 . . . . 0.0 111.407 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 15.3 t -52.37 -44.97 65.58 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 170.151 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.8 -44.88 93.74 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-O 118.826 -0.607 . . . . 0.0 109.951 -178.859 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.416 ' HA ' ' CE1' ' A' ' 23' ' ' TYR . 4.9 mm-40 -65.44 -41.34 93.58 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 119.243 0.928 . . . . 0.0 110.65 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.75 -11.87 14.21 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.069 0.948 . . . . 0.0 113.102 171.508 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 57.8 m-80 -125.35 10.09 7.95 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.085 1.354 . . . . 0.0 112.142 -176.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 13.1 m 53.43 42.36 32.0 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-O 122.723 1.249 . . . . 0.0 112.003 -178.254 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.416 ' CE1' ' HA ' ' A' ' 19' ' ' GLN 0.259 6.5 m-85 73.34 13.26 4.66 Favored 'General case' 0 N--CA 1.444 -0.749 0 C-N-CA 128.431 2.692 . . . . 0.0 114.486 168.504 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 68.7 mtm -69.86 84.8 0.49 Allowed 'General case' 0 N--CA 1.441 -0.922 0 C-N-CA 124.876 1.27 . . . . 0.0 109.725 169.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -53.34 -25.1 13.83 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.828 0.851 . . . . 0.0 111.337 170.662 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.5 m -51.16 -40.47 58.67 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 126.631 1.972 . . . . 0.0 112.587 170.03 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 54.2 mmtt -74.52 -47.9 30.24 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.358 1.063 . . . . 0.0 108.8 175.507 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 82.3 m -71.65 3.21 4.22 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.905 1.282 . . . . 0.0 113.224 -176.776 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 41.3 mm-40 -54.8 -32.9 60.81 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 119.488 1.04 . . . . 0.0 110.151 167.767 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.99 -58.89 6.17 Favored 'General case' 0 C--N 1.345 0.408 0 C-N-CA 124.977 1.311 . . . . 0.0 111.333 175.791 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.626 HG22 HD13 ' A' ' 14' ' ' ILE . 10.6 p -69.85 -32.27 51.27 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 C-N-CA 124.013 0.925 . . . . 0.0 109.761 -174.206 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.416 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 72.4 mt -60.42 -48.28 89.02 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 N-CA-C 107.106 -1.442 . . . . 0.0 107.106 170.156 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.421 ' HA ' ' HG3' ' A' ' 36' ' ' ARG . 1.6 tp-100 -59.26 -20.39 53.84 Favored 'General case' 0 N--CA 1.439 -0.976 0 O-C-N 121.08 -1.013 . . . . 0.0 112.692 175.589 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.3 tp10 -80.36 -34.93 36.13 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 120.366 1.439 . . . . 0.0 111.83 169.559 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.477 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.9 mt -58.82 -27.13 64.8 Favored 'General case' 0 C--N 1.345 0.399 0 CA-C-N 120.298 1.408 . . . . 0.0 109.456 172.742 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.421 ' HG3' ' HA ' ' A' ' 33' ' ' GLN . 18.3 mmt85 -64.17 -52.22 60.02 Favored 'General case' 0 CA--C 1.52 -0.206 0 C-N-CA 123.915 0.886 . . . . 0.0 109.487 176.362 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -67.99 -28.09 67.13 Favored 'General case' 0 C--O 1.235 0.304 0 O-C-N 123.572 0.545 . . . . 0.0 111.036 -177.73 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 49.8 t -68.11 -53.0 28.59 Favored 'General case' 0 N--CA 1.438 -1.041 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 168.19 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 51.8 t -64.12 -50.53 67.9 Favored 'General case' 0 CA--C 1.515 -0.389 0 C-N-CA 124.33 1.052 . . . . 0.0 112.381 -169.332 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.93 0.95 3.81 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.708 0.803 . . . . 0.0 112.613 -173.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.564 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 9.5 tt0 -82.82 -11.17 58.45 Favored 'General case' 0 N--CA 1.439 -1.008 0 C-N-CA 126.721 2.008 . . . . 0.0 110.855 176.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.564 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 77.1 m-85 -139.92 162.02 52.79 Favored Pre-proline 0 N--CA 1.445 -0.677 0 C-N-CA 125.125 1.37 . . . . 0.0 111.877 -168.093 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.43 144.77 46.22 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 N-CA-C 107.692 -1.696 . . . . 0.0 107.692 166.148 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 55.3 tttp -52.23 -40.73 62.02 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 114.189 1.181 . . . . 0.0 114.189 -170.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -64.92 -7.63 30.81 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 124.016 0.817 . . . . 0.0 113.604 -179.114 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.3 tpm_? -70.33 -21.16 62.94 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 118.957 1.379 . . . . 0.0 111.61 172.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.8 t -150.69 135.18 17.17 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-O 122.982 1.372 . . . . 0.0 112.867 -169.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 13.4 t -67.43 -52.57 40.4 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 CA-C-N 113.39 -1.732 . . . . 0.0 108.449 175.831 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 3.1 m -64.28 -41.82 93.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 CA-C-O 118.321 -0.847 . . . . 0.0 109.923 -176.412 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' CYS . . . . . 0.42 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 43.9 t -64.53 -30.51 71.53 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.708 1.603 . . . . 0.0 110.019 177.219 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 48.9 m -67.01 -32.37 73.56 Favored 'General case' 0 CA--C 1.536 0.41 0 O-C-N 121.682 -0.636 . . . . 0.0 110.903 170.404 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.51 -33.36 84.44 Favored Glycine 0 C--N 1.344 0.985 0 CA-C-O 123.033 1.352 . . . . 0.0 111.397 168.193 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.477 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.7 OUTLIER -81.03 -45.35 16.69 Favored 'General case' 0 N--CA 1.423 -1.812 0 N-CA-C 115.785 1.772 . . . . 0.0 115.785 -165.695 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -62.87 -27.55 69.43 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 119.121 -0.466 . . . . 0.0 110.219 169.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 58.9 tptt -70.22 -39.54 75.07 Favored 'General case' 0 C--N 1.347 0.495 0 CA-C-N 119.025 0.83 . . . . 0.0 110.526 168.705 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -59.15 -41.67 88.89 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 118.846 0.748 . . . . 0.0 110.501 171.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -65.33 -40.64 93.96 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.161 0.984 . . . . 0.0 110.326 178.347 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -59.84 -43.04 94.81 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 118.228 0.467 . . . . 0.0 110.615 170.408 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -59.77 -38.87 83.04 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.234 0.614 . . . . 0.0 111.437 172.684 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -64.91 -34.84 79.35 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 117.975 -1.012 . . . . 0.0 111.142 178.61 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 92.0 mt -64.2 -14.91 58.49 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 118.787 0.721 . . . . 0.0 112.611 171.086 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 19.5 p -85.47 -48.95 8.48 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 119.909 1.231 . . . . 0.0 109.85 169.001 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 31.8 ttp180 -58.69 -66.21 0.53 Allowed 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 125.973 1.709 . . . . 0.0 110.368 -178.453 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -83.06 77.33 9.76 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 103.647 -2.723 . . . . 0.0 103.647 168.411 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 5.1 m -51.97 129.12 26.28 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 114.101 1.148 . . . . 0.0 114.101 -166.085 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -167.34 -161.87 0.43 Allowed 'General case' 0 N--CA 1.444 -0.736 0 C-N-CA 129.901 3.281 . . . . 0.0 106.478 -169.202 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 51.4 m -156.25 169.99 23.28 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 124.646 1.178 . . . . 0.0 108.672 168.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 58.6 tptt . . . . . 0 CA--C 1.53 0.183 0 C-N-CA 124.419 1.088 . . . . 0.0 110.596 -175.01 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.644 0 CA-C-O 119.214 -0.422 . . . . 0.0 111.343 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -64.87 119.38 6.4 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 123.512 2.808 . . . . 0.0 111.2 -173.254 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -152.71 -177.81 6.49 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 128.631 2.772 . . . . 0.0 107.355 -171.479 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 65.7 tttm -65.33 96.03 0.22 Allowed 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 166.594 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -94.94 99.32 4.1 Favored Pre-proline 0 C--N 1.324 -0.52 0 C-N-CA 127.141 2.176 . . . . 0.0 108.895 -171.07 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -56.68 -35.75 97.75 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 123.626 2.884 . . . . 0.0 112.211 -173.777 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 95.0 m -92.89 -7.96 44.7 Favored 'General case' 0 N--CA 1.442 -0.843 0 C-N-CA 126.246 1.818 . . . . 0.0 113.49 -168.802 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.6 tp60 -61.66 -24.78 66.96 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 117.966 0.348 . . . . 0.0 110.592 179.036 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 61.1 tttm -56.98 -60.01 4.21 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 125.209 1.404 . . . . 0.0 109.758 167.63 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 19.8 mp0 -57.81 -45.6 85.86 Favored 'General case' 0 C--O 1.225 -0.204 0 C-N-CA 123.88 0.872 . . . . 0.0 110.206 -176.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -52.54 -41.82 63.84 Favored 'General case' 0 C--N 1.338 0.096 0 C-N-CA 125.055 1.342 . . . . 0.0 112.697 173.392 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 92.4 m -61.69 -47.51 84.98 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 117.706 0.23 . . . . 0.0 110.609 172.504 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -62.21 -24.51 67.26 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-O 117.8 -1.095 . . . . 0.0 112.262 -179.102 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 35.8 mm -56.05 -53.4 39.12 Favored 'Isoleucine or valine' 0 C--N 1.343 0.29 0 CA-C-N 120.126 1.33 . . . . 0.0 109.624 172.556 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -58.73 -54.35 48.03 Favored 'General case' 0 N--CA 1.445 -0.68 0 O-C-N 124.025 0.828 . . . . 0.0 109.196 -179.484 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -66.7 -31.98 73.0 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 119.132 -1.027 . . . . 0.0 111.675 -174.687 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 20.4 t -56.48 -48.74 76.48 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 119.362 0.983 . . . . 0.0 108.681 169.23 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.05 -46.88 84.65 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 123.178 0.591 . . . . 0.0 110.429 179.461 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -56.98 -46.28 82.35 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.663 0.785 . . . . 0.0 111.258 174.22 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.59 -12.74 55.82 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.127 0.971 . . . . 0.0 113.475 175.482 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.3 m-80 -123.87 8.65 8.75 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.65 1.18 . . . . 0.0 112.149 -173.001 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 58.23 40.27 24.94 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 122.376 1.084 . . . . 0.0 110.873 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.262 7.1 m-85 71.97 14.08 5.87 Favored 'General case' 0 N--CA 1.444 -0.764 0 C-N-CA 127.876 2.47 . . . . 0.0 114.66 168.8 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 65.8 mtm -69.62 86.26 0.47 Allowed 'General case' 0 N--CA 1.443 -0.823 0 C-N-CA 125.147 1.379 . . . . 0.0 109.982 169.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -53.37 -25.87 17.14 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.414 0.686 . . . . 0.0 111.4 169.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.9 m -53.4 -38.66 63.63 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.834 2.054 . . . . 0.0 112.709 171.139 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.6 mmtm -73.98 -47.95 33.69 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 124.224 1.01 . . . . 0.0 108.58 173.361 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.2 m -73.09 2.7 6.6 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 124.753 1.221 . . . . 0.0 113.567 -173.805 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 27.1 mm-40 -54.49 -28.44 44.82 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 119.604 1.093 . . . . 0.0 110.08 167.268 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.73 -58.44 8.57 Favored 'General case' 0 C--N 1.348 0.504 0 C-N-CA 126.087 1.755 . . . . 0.0 111.955 172.585 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.6 p -72.59 -30.28 33.4 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 C-N-CA 123.873 0.869 . . . . 0.0 110.074 -174.002 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.512 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 75.9 mt -59.18 -48.76 85.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 N-CA-C 106.229 -1.767 . . . . 0.0 106.229 168.675 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.1 -25.8 59.38 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 121.014 -1.054 . . . . 0.0 113.454 174.048 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 49.6 tt0 -75.08 -39.78 60.55 Favored 'General case' 0 N--CA 1.434 -1.249 0 C-N-CA 119.353 -0.939 . . . . 0.0 110.486 174.494 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.463 ' HB3' ' CE2' ' A' ' 53' ' ' PHE . 3.4 mt -57.95 -31.92 67.31 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-O 117.863 -1.065 . . . . 0.0 109.304 169.474 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 19.1 mmt85 -66.19 -56.9 9.06 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 120.143 1.338 . . . . 0.0 109.145 -178.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 12.3 ptmm? -67.94 -22.19 65.06 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.651 -176.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.4 t -73.16 -51.92 16.07 Favored 'General case' 0 N--CA 1.439 -1.013 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 166.852 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 43.1 t -60.82 -52.27 65.79 Favored 'General case' 0 CA--C 1.514 -0.442 0 C-N-CA 124.404 1.082 . . . . 0.0 112.16 -170.722 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.16 1.67 4.5 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.382 -0.826 . . . . 0.0 112.554 -173.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.555 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 11.6 tt0 -85.29 -11.7 54.12 Favored 'General case' 0 N--CA 1.44 -0.944 0 C-N-CA 126.451 1.9 . . . . 0.0 111.168 -179.127 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.555 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 73.8 m-85 -135.37 160.48 67.8 Favored Pre-proline 0 N--CA 1.447 -0.623 0 C-N-CA 124.907 1.283 . . . . 0.0 111.168 -168.863 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -65.07 120.38 7.6 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 N-CA-C 105.416 -2.571 . . . . 0.0 105.416 165.576 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -43.79 -40.05 4.15 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 115.158 1.54 . . . . 0.0 115.158 -167.5 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.58 -9.71 14.18 Favored Glycine 0 CA--C 1.533 1.202 0 C-N-CA 124.845 1.212 . . . . 0.0 114.048 178.827 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.43 -26.65 68.83 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 119.06 1.43 . . . . 0.0 111.478 169.517 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 11.1 t -140.23 132.12 27.63 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-O 123.235 1.493 . . . . 0.0 112.727 -169.066 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 19.1 t -68.52 -52.06 40.25 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.655 0 CA-C-N 112.762 -2.017 . . . . 0.0 108.365 175.422 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 12.4 m -62.86 -41.86 94.23 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 CA-C-O 118.363 -0.827 . . . . 0.0 110.313 -176.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 29.3 t -63.66 -34.11 77.12 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.669 1.588 . . . . 0.0 110.183 176.161 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.9 m -67.65 -28.72 67.96 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 122.854 0.462 . . . . 0.0 110.708 171.772 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -67.89 -34.03 81.29 Favored Glycine 0 C--N 1.346 1.107 0 CA-C-O 123.15 1.417 . . . . 0.0 111.315 167.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.512 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 0.6 OUTLIER -80.38 -44.34 19.56 Favored 'General case' 0 N--CA 1.421 -1.914 0 N-CA-C 115.877 1.806 . . . . 0.0 115.877 -165.64 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -62.09 -22.64 65.96 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 118.779 -0.629 . . . . 0.0 110.393 170.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 59.2 tttp -76.35 -46.25 28.37 Favored 'General case' 0 C--N 1.349 0.566 0 CA-C-N 119.233 0.924 . . . . 0.0 109.694 166.026 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -52.22 -39.71 60.62 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.171 0.988 . . . . 0.0 110.982 177.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -61.04 -37.82 83.98 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 126.098 1.759 . . . . 0.0 111.225 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -61.36 -47.63 85.0 Favored 'General case' 0 C--O 1.226 -0.175 0 CA-C-O 118.413 -0.803 . . . . 0.0 109.5 170.016 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -56.68 -38.2 71.91 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 119.194 0.907 . . . . 0.0 110.943 179.529 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASN . . . . . 0.505 ' ND2' HH12 ' A' ' 63' ' ' ARG . 2.2 m-80 -69.43 -31.1 69.23 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.918 0.887 . . . . 0.0 112.21 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 73.6 mt -76.09 -41.63 49.81 Favored 'General case' 0 C--O 1.225 -0.207 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 175.647 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -54.73 -38.88 67.66 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.425 1.49 . . . . 0.0 111.184 169.839 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.505 HH12 ' ND2' ' A' ' 60' ' ' ASN . 77.0 mtm-85 -66.63 -59.39 3.64 Favored 'General case' 0 C--N 1.345 0.41 0 CA-C-N 119.403 1.001 . . . . 0.0 109.753 169.085 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -73.1 65.74 0.8 Allowed 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 126.8 2.04 . . . . 0.0 110.918 -177.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.3 m -174.17 -164.15 0.18 Allowed 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 129.513 3.125 . . . . 0.0 105.132 -178.687 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -64.51 91.3 0.08 Allowed 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 167.665 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.4 m -65.21 41.0 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 128.976 2.91 . . . . 0.0 116.208 -168.281 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 10.8 mptt . . . . . 0 N--CA 1.465 0.316 0 C-N-CA 126.701 2.001 . . . . 0.0 110.313 175.113 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 91.2 mtp . . . . . 0 CA--C 1.538 0.486 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.83 159.94 50.57 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.425 2.083 . . . . 0.0 110.858 170.093 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -61.13 -26.52 67.74 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.012 1.725 . . . . 0.0 112.902 -171.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -147.38 177.15 9.46 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 127.753 2.421 . . . . 0.0 106.608 171.089 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.2 t0 -136.4 93.86 14.2 Favored Pre-proline 0 N--CA 1.448 -0.566 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 172.057 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -55.45 -33.53 86.26 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 124.204 3.269 . . . . 0.0 112.821 -175.431 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 63.1 m -94.61 -10.41 32.04 Favored 'General case' 0 N--CA 1.438 -1.068 0 C-N-CA 125.599 1.56 . . . . 0.0 113.19 -169.763 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 26.5 tp60 -62.6 -24.94 67.83 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 118.806 0.73 . . . . 0.0 111.161 -179.415 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -60.1 -54.38 46.58 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.434 1.094 . . . . 0.0 109.988 168.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -63.64 -38.83 92.62 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.655 0.782 . . . . 0.0 110.242 -177.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.14 -43.46 70.55 Favored 'General case' 0 C--N 1.341 0.197 0 C-N-CA 124.98 1.312 . . . . 0.0 112.645 169.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 77.8 m -57.56 -44.71 85.48 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 121.228 -0.189 . . . . 0.0 110.731 173.259 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -62.01 -25.81 67.87 Favored 'General case' 0 C--O 1.226 -0.137 0 CA-C-O 117.779 -1.105 . . . . 0.0 112.14 178.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 22.9 mm -59.38 -54.18 37.94 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.288 0 CA-C-N 120.251 1.387 . . . . 0.0 109.393 173.662 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -59.47 -53.45 58.05 Favored 'General case' 0 N--CA 1.445 -0.708 0 O-C-N 123.991 0.807 . . . . 0.0 109.014 -178.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.47 -31.99 72.52 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 118.987 -1.085 . . . . 0.0 111.664 -175.585 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.0 t -55.82 -48.03 76.16 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 119.42 1.009 . . . . 0.0 108.728 168.824 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.14 -47.24 83.93 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 123.279 0.632 . . . . 0.0 110.277 179.123 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -56.92 -46.25 82.12 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.45 0.7 . . . . 0.0 111.3 174.325 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.4 -13.97 59.86 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.017 0.927 . . . . 0.0 113.301 175.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.4 m-80 -124.13 10.32 8.73 Favored 'General case' 0 C--N 1.342 0.278 0 C-N-CA 124.458 1.103 . . . . 0.0 112.121 -173.07 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 14.8 m 58.22 39.99 25.24 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 119.825 1.193 . . . . 0.0 111.129 178.787 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.275 6.9 m-85 73.27 14.76 4.47 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 127.902 2.481 . . . . 0.0 114.774 168.635 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 50.6 mtm -66.57 85.15 0.11 Allowed 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 125.677 1.591 . . . . 0.0 110.251 169.397 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -56.95 -18.18 12.48 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.609 1.164 . . . . 0.0 112.157 170.124 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.4 p -61.5 -58.27 8.83 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 127.138 2.175 . . . . 0.0 110.797 167.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.5 mmtp -54.43 -41.0 68.88 Favored 'General case' 0 C--N 1.339 0.121 0 C-N-CA 123.392 0.677 . . . . 0.0 109.415 173.329 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.3 m -80.65 7.12 10.84 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -176.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 79.6 mm-40 -59.35 -27.42 65.92 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.833 1.197 . . . . 0.0 110.841 167.503 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.22 -54.3 48.41 Favored 'General case' 0 C--N 1.345 0.379 0 C-N-CA 125.513 1.525 . . . . 0.0 111.63 173.089 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.2 p -76.58 -28.74 17.88 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.811 0 C-N-CA 123.69 0.796 . . . . 0.0 109.838 -175.256 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 22.4 mt -59.74 -46.41 93.53 Favored 'Isoleucine or valine' 0 C--N 1.344 0.335 0 N-CA-C 107.034 -1.469 . . . . 0.0 107.034 167.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.34 -30.33 51.1 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 123.166 0.586 . . . . 0.0 112.358 173.831 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -78.18 -39.73 39.88 Favored 'General case' 0 N--CA 1.429 -1.518 0 C-N-CA 120.232 -0.587 . . . . 0.0 111.633 177.515 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.414 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.9 mt -63.65 -33.02 74.7 Favored 'General case' 0 C--N 1.343 0.315 0 CA-C-N 119.559 1.072 . . . . 0.0 110.362 172.272 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.12 -61.92 2.2 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.942 1.297 . . . . 0.0 109.406 175.734 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.9 ptmt -65.92 -29.76 70.23 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 114.51 -1.223 . . . . 0.0 110.888 -174.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 52.1 t -62.56 -51.21 68.27 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 168.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.6 t -60.54 -46.75 89.03 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.324 0.65 . . . . 0.0 111.309 -173.43 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.73 -1.94 4.42 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 125.097 1.359 . . . . 0.0 113.247 -179.3 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.55 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 21.0 tt0 -80.18 -10.87 59.78 Favored 'General case' 0 N--CA 1.44 -0.969 0 C-N-CA 123.969 0.907 . . . . 0.0 110.591 172.293 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.55 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 68.3 m-85 -139.37 161.06 59.25 Favored Pre-proline 0 N--CA 1.447 -0.613 0 C-N-CA 124.556 1.143 . . . . 0.0 112.476 -168.454 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -68.21 123.49 10.65 Favored 'Trans proline' 0 N--CA 1.457 -0.675 0 N-CA-C 104.814 -2.802 . . . . 0.0 104.814 164.095 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.0 ptmt -48.97 -33.63 11.37 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 116.5 2.037 . . . . 0.0 116.5 -166.219 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.85 -15.05 40.28 Favored Glycine 0 CA--C 1.532 1.134 0 CA-C-N 118.899 0.772 . . . . 0.0 113.806 178.282 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.8 tpm_? -64.58 -12.95 50.44 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 125.223 1.409 . . . . 0.0 112.457 171.359 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.9 t -149.93 141.09 23.07 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 122.478 1.132 . . . . 0.0 111.756 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.5 t -71.8 -54.12 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 CA-C-N 114.571 -1.195 . . . . 0.0 108.913 178.116 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 6.8 m -59.52 -39.46 79.38 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 122.63 0.372 . . . . 0.0 110.085 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' CYS . . . . . 0.493 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 12.2 t -67.54 -37.23 82.4 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.686 1.195 . . . . 0.0 110.176 177.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 54.1 m -63.7 -27.83 69.48 Favored 'General case' 0 N--CA 1.453 -0.32 0 O-C-N 121.883 -0.511 . . . . 0.0 110.87 172.509 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.29 -25.47 72.96 Favored Glycine 0 C--N 1.343 0.958 0 CA-C-O 122.025 0.791 . . . . 0.0 112.195 170.492 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.493 ' HB2' ' HA ' ' A' ' 50' ' ' CYS . 0.2 OUTLIER -82.35 -49.45 10.01 Favored 'General case' 0 N--CA 1.433 -1.309 0 C-N-CA 126.087 1.755 . . . . 0.0 115.12 -167.72 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -66.23 -20.97 66.27 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.105 172.787 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -72.05 -40.7 68.16 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 118.514 0.597 . . . . 0.0 109.967 166.484 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -55.53 -45.94 77.12 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 119.457 1.026 . . . . 0.0 109.825 169.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 30.1 tp10 -63.67 -34.29 77.52 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.821 0.848 . . . . 0.0 111.391 178.443 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -60.89 -31.91 71.37 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 118.731 0.696 . . . . 0.0 111.514 172.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -67.64 -53.26 29.36 Favored 'General case' 0 C--N 1.341 0.198 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 168.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -64.78 -34.89 79.41 Favored 'General case' 0 C--O 1.231 0.115 0 C-N-CA 123.797 0.839 . . . . 0.0 112.385 -168.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 4.2 pp -61.73 -19.32 62.28 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 118.799 0.727 . . . . 0.0 112.639 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 40.5 p -65.68 -53.63 38.51 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-N 118.798 0.726 . . . . 0.0 109.421 170.281 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -36.77 84.71 Favored 'General case' 0 C--N 1.339 0.116 0 C-N-CA 124.396 1.078 . . . . 0.0 111.037 178.783 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -69.36 17.94 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 177.232 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 66.3 m -69.04 169.75 11.23 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 125.441 1.496 . . . . 0.0 109.869 168.236 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.74 139.52 53.68 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 121.161 0.505 . . . . 0.0 110.19 171.703 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 41.8 m -168.1 172.27 8.88 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 126.615 1.966 . . . . 0.0 107.49 175.2 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 63.4 tttp . . . . . 0 CA--C 1.531 0.219 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 174.091 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.6 mtt . . . . . 0 CA--C 1.539 0.536 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -78.49 64.46 8.55 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 123.738 2.959 . . . . 0.0 110.801 176.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -68.52 24.58 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 127.013 2.125 . . . . 0.0 113.731 -176.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt 47.59 -127.74 1.73 Allowed 'General case' 0 C--N 1.344 0.34 0 C-N-CA 125.088 1.355 . . . . 0.0 108.617 -169.698 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -91.28 97.5 1.36 Allowed Pre-proline 0 C--N 1.32 -0.693 0 N-CA-C 106.369 -1.715 . . . . 0.0 106.369 168.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -56.01 -37.04 96.75 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 123.536 2.824 . . . . 0.0 112.362 -169.39 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 67.5 m -92.92 -8.86 42.03 Favored 'General case' 0 N--CA 1.438 -1.053 0 C-N-CA 125.707 1.603 . . . . 0.0 113.396 -168.699 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 28.8 tp60 -62.27 -25.05 67.63 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 118.321 0.509 . . . . 0.0 110.51 178.328 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.3 tmtm? -58.27 -56.93 15.69 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.387 1.075 . . . . 0.0 109.446 168.435 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 21.1 mp0 -61.96 -39.13 91.07 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.037 0.935 . . . . 0.0 110.749 -177.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -55.27 -44.83 76.0 Favored 'General case' 0 C--N 1.338 0.108 0 C-N-CA 124.319 1.048 . . . . 0.0 112.203 170.413 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.4 m -59.02 -41.65 88.28 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 121.06 -0.256 . . . . 0.0 111.078 172.329 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -64.26 -21.96 66.78 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-O 117.432 -1.27 . . . . 0.0 112.941 176.744 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.421 HD13 HG13 ' A' ' 31' ' ' VAL . 44.3 mm -59.64 -51.1 76.74 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-N 121.029 1.74 . . . . 0.0 109.34 172.593 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 8.4 mm-40 -61.14 -55.89 27.19 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 108.274 -1.009 . . . . 0.0 108.274 178.605 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 17.7 mtpp -66.2 -27.84 68.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 118.405 -0.807 . . . . 0.0 111.481 -172.082 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.404 ' CB ' HG11 ' A' ' 31' ' ' VAL . 15.7 t -56.71 -51.36 69.1 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 119.14 0.882 . . . . 0.0 109.034 168.837 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.416 HD12 ' SG ' ' A' ' 28' ' ' CYS . 0.2 OUTLIER -56.05 -46.71 78.83 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 123.524 0.729 . . . . 0.0 110.723 178.061 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.458 ' HA ' ' CE1' ' A' ' 23' ' ' TYR . 1.5 mp0 -56.86 -44.49 82.23 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 122.908 0.483 . . . . 0.0 111.635 174.883 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.18 -14.38 61.79 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 177.061 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -120.89 14.19 11.55 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.362 1.065 . . . . 0.0 113.248 -168.665 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 17.2 m 60.98 35.98 18.81 Favored 'General case' 0 C--N 1.346 0.442 0 CA-C-N 120.55 1.523 . . . . 0.0 110.035 -178.244 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.458 ' CE1' ' HA ' ' A' ' 19' ' ' GLN . 45.4 m-85 66.63 16.68 10.46 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 126.516 1.926 . . . . 0.0 113.597 168.555 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 58.0 mtm -72.27 88.04 1.14 Allowed 'General case' 0 N--CA 1.438 -1.039 0 C-N-CA 126.36 1.864 . . . . 0.0 108.808 173.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -52.85 -27.97 20.78 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.016 0.927 . . . . 0.0 110.532 170.577 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.0 m -57.22 -35.94 70.28 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 127.184 2.194 . . . . 0.0 113.325 171.274 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.5 mmtm -72.82 -43.5 62.6 Favored 'General case' 0 C--O 1.233 0.214 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 170.595 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.416 ' SG ' HD12 ' A' ' 18' ' ' LEU 0.25 74.7 m -73.42 1.42 9.77 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 123.875 0.87 . . . . 0.0 113.116 -170.495 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.418 ' HA ' HD12 ' A' ' 32' ' ' ILE . 61.6 mm-40 -55.56 -31.87 62.53 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.319 -0.863 . . . . 0.0 109.919 165.718 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.97 -53.48 57.78 Favored 'General case' 0 C--N 1.346 0.423 0 C-N-CA 124.531 1.132 . . . . 0.0 111.684 173.326 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.421 HG13 HD13 ' A' ' 14' ' ' ILE . 7.5 p -75.97 -24.47 16.6 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 C-N-CA 122.863 0.465 . . . . 0.0 110.245 -174.841 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.506 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 40.3 mt -62.53 -49.38 84.05 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 N-CA-C 106.561 -1.644 . . . . 0.0 106.561 167.88 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -55.92 -29.9 60.8 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 118.94 0.791 . . . . 0.0 111.142 174.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -71.42 -44.19 65.34 Favored 'General case' 0 N--CA 1.446 -0.628 0 O-C-N 121.313 -0.867 . . . . 0.0 112.288 175.16 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.495 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.3 mt -59.77 -33.44 71.7 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-N 119.038 0.835 . . . . 0.0 109.777 172.132 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.406 ' HE ' ' HA ' ' A' ' 57' ' ' GLU . 4.6 ttt-85 -62.21 -57.01 13.04 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 126.052 1.741 . . . . 0.0 110.629 178.096 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -62.9 -35.64 80.71 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 124.486 1.114 . . . . 0.0 110.872 -179.604 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.3 t -62.38 -50.27 72.24 Favored 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 169.561 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 52.6 t -63.94 -48.93 74.59 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 123.2 0.6 . . . . 0.0 111.724 -170.348 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.4 -0.65 5.14 Favored 'General case' 0 N--CA 1.444 -0.737 0 C-N-CA 124.575 1.15 . . . . 0.0 112.091 -177.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.471 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 2.1 tp-100 -80.06 -7.49 58.89 Favored 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 123.797 0.839 . . . . 0.0 110.963 173.475 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.471 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 73.3 m-85 -143.28 161.36 48.1 Favored Pre-proline 0 N--CA 1.444 -0.749 0 C-N-CA 124.286 1.035 . . . . 0.0 112.472 -168.74 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -69.24 110.15 2.38 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 N-CA-C 105.284 -2.622 . . . . 0.0 105.284 164.815 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -43.52 -30.49 0.58 Allowed 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 117.937 2.569 . . . . 0.0 117.937 -166.584 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -55.39 -16.44 9.98 Favored Glycine 0 CA--C 1.538 1.5 0 CA-C-N 119.559 1.072 . . . . 0.0 114.071 172.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 12.7 tpt180 -54.12 -28.22 38.22 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 127.062 2.145 . . . . 0.0 111.789 168.432 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.2 t -146.63 140.89 26.35 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-O 122.483 1.135 . . . . 0.0 112.36 -169.647 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 11.7 t -69.26 -55.66 14.54 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-N 114.107 -1.406 . . . . 0.0 108.941 178.079 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 7.6 m -59.21 -41.72 84.73 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 122.897 0.479 . . . . 0.0 109.915 -177.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' CYS . . . . . 0.49 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 14.0 t -67.33 -35.55 79.64 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.967 1.307 . . . . 0.0 110.044 179.211 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 54.7 m -65.95 -23.63 66.64 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 118.734 -0.651 . . . . 0.0 111.156 172.506 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -77.12 -26.91 61.0 Favored Glycine 0 C--N 1.345 1.04 0 CA-C-O 122.423 1.013 . . . . 0.0 111.832 168.605 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.506 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 0.4 OUTLIER -80.15 -41.54 25.18 Favored 'General case' 0 N--CA 1.42 -1.958 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 -166.8 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -62.27 -20.49 64.33 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 123.883 0.739 . . . . 0.0 111.164 177.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.419 ' HA ' ' HE2' ' A' ' 55' ' ' LYS . 0.2 OUTLIER -67.29 -54.96 16.08 Favored 'General case' 0 C--N 1.348 0.531 0 CA-C-N 118.823 0.738 . . . . 0.0 109.647 167.511 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.9 tp10 -56.42 -41.67 76.75 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.57 1.148 . . . . 0.0 111.15 178.56 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.406 ' HA ' ' HE ' ' A' ' 36' ' ' ARG . 44.2 tt0 -57.75 -42.29 83.66 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 127.808 2.443 . . . . 0.0 110.727 -179.304 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -67.2 -33.6 75.72 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.972 1.309 . . . . 0.0 111.471 177.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 47.3 mm-40 -66.49 -48.91 68.32 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 121.814 0.816 . . . . 0.0 109.66 169.641 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -70.51 -33.72 71.51 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 117.089 -1.434 . . . . 0.0 113.256 -168.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 4.0 pp -59.47 -12.78 6.8 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 119.615 1.098 . . . . 0.0 113.462 -175.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 35.5 p -55.7 -60.5 3.36 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.436 1.495 . . . . 0.0 108.787 167.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 45.3 ttp180 -71.6 -63.96 1.02 Allowed 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 127.771 2.428 . . . . 0.0 110.081 172.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -80.61 45.06 0.76 Allowed 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 128.988 2.915 . . . . 0.0 111.335 -171.291 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -76.27 179.91 5.48 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 126.069 1.748 . . . . 0.0 110.155 168.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.07 -178.94 0.5 Allowed 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.185 0.994 . . . . 0.0 110.788 168.61 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 6.9 m -65.62 66.96 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 127.068 2.147 . . . . 0.0 113.771 -176.229 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 47.0 mtmt . . . . . 0 N--CA 1.464 0.233 0 C-N-CA 126.436 1.894 . . . . 0.0 110.245 176.888 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.52 ' N ' HH12 ' A' ' 46' ' ' ARG . 26.1 mmt . . . . . 0 CA--C 1.538 0.509 0 CA-C-O 118.861 -0.59 . . . . 0.0 109.592 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -75.9 70.5 5.88 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 123.365 2.71 . . . . 0.0 109.558 169.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -141.91 165.12 28.33 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 127.339 2.256 . . . . 0.0 109.418 -178.567 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -65.77 -178.93 0.62 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.558 1.143 . . . . 0.0 112.523 -178.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.2 t0 -93.01 97.65 1.9 Allowed Pre-proline 0 CA--C 1.539 0.533 0 N-CA-C 106.148 -1.797 . . . . 0.0 106.148 168.383 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo -62.04 -30.67 83.24 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 124.318 3.345 . . . . 0.0 112.685 -172.131 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 89.9 m -93.29 -14.17 27.3 Favored 'General case' 0 N--CA 1.437 -1.076 0 C-N-CA 124.863 1.265 . . . . 0.0 112.299 -168.456 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 21.4 tp60 -60.48 -25.53 66.12 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 123.432 0.693 . . . . 0.0 110.739 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 65.9 tttp -62.08 -56.85 14.71 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 124.14 0.976 . . . . 0.0 110.162 168.533 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -61.15 -37.7 83.79 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.788 0.835 . . . . 0.0 110.481 -176.355 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.49 -43.64 71.96 Favored 'General case' 0 CA--C 1.52 -0.195 0 C-N-CA 125.186 1.394 . . . . 0.0 112.826 169.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.8 m -58.75 -43.86 90.39 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 121.028 0.442 . . . . 0.0 110.817 173.092 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 40.2 mm-40 -64.27 -21.1 66.47 Favored 'General case' 0 N--CA 1.456 -0.151 0 CA-C-O 117.735 -1.126 . . . . 0.0 112.387 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.402 HD13 HG13 ' A' ' 31' ' ' VAL . 36.8 mm -60.12 -52.62 59.1 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 CA-C-N 120.574 1.534 . . . . 0.0 109.363 171.753 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -58.27 -55.52 33.96 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 107.624 -1.251 . . . . 0.0 107.624 -179.231 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 41.1 mtpt -70.02 -29.44 66.5 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 118.201 -0.904 . . . . 0.0 111.64 -170.449 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.411 ' CB ' HG11 ' A' ' 31' ' ' VAL . 16.8 t -56.87 -47.05 81.36 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 168.57 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.15 -45.45 90.93 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 118.377 -0.82 . . . . 0.0 110.133 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -58.47 -46.53 86.42 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 119.428 1.013 . . . . 0.0 111.222 174.228 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.05 -14.57 55.41 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.811 0.844 . . . . 0.0 113.24 176.118 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -122.56 9.16 9.58 Favored 'General case' 0 C--N 1.342 0.256 0 C-N-CA 124.228 1.011 . . . . 0.0 112.231 -173.604 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.6 m 58.25 40.23 24.91 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 122.601 1.191 . . . . 0.0 110.776 179.1 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.26 7.1 m-85 72.14 15.1 5.53 Favored 'General case' 0 N--CA 1.443 -0.812 0 C-N-CA 127.914 2.485 . . . . 0.0 114.316 169.075 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 67.3 mtm -70.44 86.82 0.62 Allowed 'General case' 0 N--CA 1.441 -0.915 0 C-N-CA 125.5 1.52 . . . . 0.0 110.047 169.715 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -55.05 -23.47 20.19 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 125.769 1.628 . . . . 0.0 110.569 168.183 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -55.26 -41.53 72.31 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.864 1.665 . . . . 0.0 112.004 169.576 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 50.6 mmtt -73.7 -45.68 50.83 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.991 0.916 . . . . 0.0 108.555 175.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.1 m -73.68 1.6 9.92 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -172.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.471 HE22 ' NH1' ' A' ' 63' ' ' ARG . 65.4 mm-40 -51.81 -34.57 40.72 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 119.105 0.866 . . . . 0.0 109.986 166.509 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.68 -57.4 12.9 Favored 'General case' 0 C--N 1.346 0.425 0 C-N-CA 125.757 1.623 . . . . 0.0 111.447 175.087 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.411 HG11 ' CB ' ' A' ' 17' ' ' CYS . 8.7 p -72.44 -29.79 32.45 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.645 0 C-N-CA 123.618 0.767 . . . . 0.0 110.194 -173.844 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.44 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 56.2 mt -59.97 -50.66 79.27 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 N-CA-C 106.129 -1.804 . . . . 0.0 106.129 168.621 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.417 HE22 ' NH1' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -56.91 -28.84 62.47 Favored 'General case' 0 N--CA 1.448 -0.574 0 O-C-N 121.635 -0.666 . . . . 0.0 112.77 175.306 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -74.99 -37.94 61.74 Favored 'General case' 0 N--CA 1.432 -1.361 0 CA-C-N 118.585 0.63 . . . . 0.0 111.39 177.155 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.416 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.4 mt -59.27 -34.11 71.86 Favored 'General case' 0 C--N 1.346 0.418 0 CA-C-N 119.502 1.046 . . . . 0.0 109.872 169.916 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.417 ' NH1' HE22 ' A' ' 33' ' ' GLN . 0.8 OUTLIER -67.13 -55.62 13.43 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.214 1.406 . . . . 0.0 111.732 179.722 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 57.4 mttm -62.09 -33.31 74.19 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 124.822 1.249 . . . . 0.0 110.326 178.345 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.3 t -64.2 -52.76 57.29 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 168.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.4 t -57.7 -50.31 73.63 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 123.762 0.825 . . . . 0.0 112.079 -172.368 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.79 -0.87 7.84 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 114.961 -1.018 . . . . 0.0 112.444 -175.739 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.468 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 2.7 tp-100 -85.38 -6.57 59.21 Favored 'General case' 0 N--CA 1.437 -1.111 0 C-N-CA 124.345 1.058 . . . . 0.0 111.548 179.408 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.468 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 77.9 m-85 -140.26 160.23 60.68 Favored Pre-proline 0 N--CA 1.445 -0.685 0 C-N-CA 124.472 1.109 . . . . 0.0 111.609 -168.7 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -67.37 118.17 5.38 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 N-CA-C 106.408 -2.189 . . . . 0.0 106.408 166.55 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 62.1 tttm -41.27 -38.15 1.1 Allowed 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 117.024 2.231 . . . . 0.0 117.024 -168.019 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.28 -13.62 16.28 Favored Glycine 0 CA--C 1.537 1.418 0 C-N-CA 123.997 0.808 . . . . 0.0 114.066 176.206 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.52 HH12 ' N ' ' A' ' 1' ' ' MET . 0.1 OUTLIER -56.77 -31.12 64.3 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 126.381 1.872 . . . . 0.0 112.057 169.495 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.5 t -146.01 136.97 24.5 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-O 123.113 1.435 . . . . 0.0 113.798 -168.028 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.1 t -71.89 -54.57 16.37 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.735 0 CA-C-N 112.726 -2.034 . . . . 0.0 108.833 177.824 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 17.7 m -60.19 -39.36 80.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 C-N-CA 123.004 0.522 . . . . 0.0 110.558 -178.643 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' CYS . . . . . 0.448 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 6.3 t -66.54 -38.9 88.13 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.102 1.361 . . . . 0.0 109.954 176.328 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 51.2 m -64.88 -26.64 68.41 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-O 119.231 -0.414 . . . . 0.0 110.822 172.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.34 -26.47 71.92 Favored Glycine 0 C--N 1.342 0.915 0 CA-C-N 118.088 0.404 . . . . 0.0 112.291 169.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.448 ' HB2' ' HA ' ' A' ' 50' ' ' CYS . 0.3 OUTLIER -81.2 -48.11 12.52 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 115.893 1.812 . . . . 0.0 115.893 -165.737 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -64.5 -19.14 65.4 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.243 173.5 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -80.27 -42.93 22.23 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.068 0.849 . . . . 0.0 109.928 166.005 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -56.22 -33.9 65.79 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.663 1.185 . . . . 0.0 110.865 176.359 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.7 tm-20 -58.75 -36.2 73.97 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.524 1.13 . . . . 0.0 110.47 176.606 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -73.45 -41.07 63.66 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.224 0.61 . . . . 0.0 109.701 174.172 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -57.54 -34.5 69.21 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.557 0.743 . . . . 0.0 112.057 174.355 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASN . . . . . 0.482 ' ND2' ' HE ' ' A' ' 63' ' ' ARG . 1.3 m-80 -60.82 -29.69 69.64 Favored 'General case' 0 C--N 1.332 -0.158 0 C-N-CA 123.664 0.786 . . . . 0.0 112.284 -178.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 54.5 mt -58.77 -30.57 67.65 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.767 0.827 . . . . 0.0 111.051 172.732 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 20.5 p -81.54 -47.76 12.67 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 124.818 1.247 . . . . 0.0 110.779 173.502 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.482 ' HE ' ' ND2' ' A' ' 60' ' ' ASN . 23.3 mtm105 -54.78 -57.47 11.42 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 123.601 0.76 . . . . 0.0 110.47 -178.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 40.32 -130.98 0.34 Allowed 'General case' 0 C--O 1.237 0.401 0 C-N-CA 125.696 1.599 . . . . 0.0 110.611 176.095 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 11.0 m -62.24 -20.63 64.43 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 126.495 1.918 . . . . 0.0 115.535 -176.459 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -83.48 19.83 1.49 Allowed 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 127.855 2.462 . . . . 0.0 113.298 175.053 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 74.6 m -66.58 76.04 0.11 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 126.244 1.818 . . . . 0.0 109.184 169.266 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.466 0.35 0 C-N-CA 127.188 2.195 . . . . 0.0 111.588 -170.081 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 CA--C 1.542 0.666 0 CA-C-O 119.816 -0.135 . . . . 0.0 111.071 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -80.52 48.6 2.94 Favored 'Trans proline' 0 CA--C 1.545 1.033 0 C-N-CA 123.389 2.726 . . . . 0.0 112.362 -172.772 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -57.39 91.45 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 126.648 1.979 . . . . 0.0 112.35 -169.039 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.7 mptp? 46.76 19.57 0.09 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 129.172 2.989 . . . . 0.0 113.387 -169.318 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -145.97 98.67 4.39 Favored Pre-proline 0 N--CA 1.442 -0.827 0 C-N-CA 128.318 2.647 . . . . 0.0 105.964 -168.31 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -53.56 -31.51 59.59 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 124.363 3.375 . . . . 0.0 112.868 -169.838 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.409 ' HB3' ' CD2' ' A' ' 35' ' ' LEU . 73.0 m -94.26 -13.69 26.27 Favored 'General case' 0 N--CA 1.428 -1.553 0 C-N-CA 126.384 1.874 . . . . 0.0 112.735 -170.414 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 32.3 tp60 -63.11 -25.58 68.43 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 118.898 0.772 . . . . 0.0 110.767 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -60.37 -53.62 55.45 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.979 0.912 . . . . 0.0 110.191 169.399 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -64.86 -38.97 92.74 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.249 0.62 . . . . 0.0 110.155 -178.162 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.07 -45.33 71.7 Favored 'General case' 0 C--N 1.341 0.216 0 C-N-CA 125.186 1.394 . . . . 0.0 112.061 169.537 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 89.1 m -57.33 -43.05 83.05 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 117.632 0.196 . . . . 0.0 110.473 173.813 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -65.06 -25.29 67.75 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-O 117.547 -1.216 . . . . 0.0 113.053 176.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 30.2 mm -58.71 -52.01 65.1 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 CA-C-N 120.677 1.581 . . . . 0.0 108.961 171.043 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -60.8 -53.5 56.65 Favored 'General case' 0 N--CA 1.442 -0.862 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 -175.7 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 16.2 mtpp -69.28 -31.1 69.38 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 118.215 -0.898 . . . . 0.0 111.849 -174.707 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.9 t -56.87 -45.9 82.18 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 169.026 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.6 -45.26 92.44 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-O 118.481 -0.771 . . . . 0.0 110.467 179.162 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -58.43 -44.81 89.26 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 119.219 0.918 . . . . 0.0 111.314 173.597 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.24 -13.46 58.38 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 113.345 0.869 . . . . 0.0 113.345 175.475 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 -124.82 9.35 8.22 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 124.483 1.113 . . . . 0.0 112.405 -172.759 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.3 m 58.04 40.12 25.69 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 122.318 1.056 . . . . 0.0 110.862 179.235 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.258 6.7 m-85 72.23 13.35 5.71 Favored 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 127.854 2.462 . . . . 0.0 114.661 168.737 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 67.3 mtm -70.78 85.87 0.67 Allowed 'General case' 0 N--CA 1.442 -0.851 0 C-N-CA 125.039 1.336 . . . . 0.0 109.798 170.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -53.58 -25.85 19.08 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.178 0.591 . . . . 0.0 111.45 171.565 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.1 m -51.09 -42.02 60.36 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 126.13 1.772 . . . . 0.0 112.317 170.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 55.1 mmtt -70.89 -47.59 58.34 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 124.188 0.995 . . . . 0.0 108.93 174.415 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.2 m -72.7 2.71 6.07 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 124.662 1.185 . . . . 0.0 113.171 -174.408 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 52.4 mm-40 -56.23 -28.25 57.78 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 119.814 1.188 . . . . 0.0 109.874 166.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.97 -56.24 24.33 Favored 'General case' 0 C--N 1.346 0.44 0 C-N-CA 125.313 1.445 . . . . 0.0 111.833 172.329 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.1 p -75.74 -26.02 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.746 0 C-N-CA 123.625 0.77 . . . . 0.0 109.826 -174.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.544 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 57.6 mt -62.75 -44.3 99.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 N-CA-C 107.309 -1.367 . . . . 0.0 107.309 168.517 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.466 HE22 ' NH1' ' A' ' 36' ' ' ARG . 2.9 tp-100 -56.47 -28.33 59.4 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 123.506 0.723 . . . . 0.0 112.379 172.401 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -74.98 -44.02 50.69 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 118.571 0.623 . . . . 0.0 111.854 173.011 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.512 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.6 mt -63.64 -30.89 71.94 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 119.294 0.952 . . . . 0.0 110.901 175.709 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.466 ' NH1' HE22 ' A' ' 33' ' ' GLN . 0.2 OUTLIER -57.26 -59.29 5.34 Favored 'General case' 0 CA--C 1.519 -0.233 0 C-N-CA 124.443 1.097 . . . . 0.0 109.415 173.502 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 48.8 mttp -60.04 -37.7 80.57 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 113.751 -1.568 . . . . 0.0 110.972 -177.295 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 42.5 t -62.2 -52.18 64.84 Favored 'General case' 0 N--CA 1.442 -0.861 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 171.179 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.5 t -61.6 -45.26 94.84 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.532 0.733 . . . . 0.0 111.888 -171.343 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.75 -2.4 11.85 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.095 -0.957 . . . . 0.0 112.883 -177.343 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.469 ' HB3' ' CE1' ' A' ' 42' ' ' TYR . 2.6 tp-100 -86.3 -5.53 59.16 Favored 'General case' 0 N--CA 1.438 -1.027 0 C-N-CA 124.651 1.18 . . . . 0.0 111.565 -178.773 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.469 ' CE1' ' HB3' ' A' ' 41' ' ' GLN . 82.7 m-85 -139.38 160.89 60.03 Favored Pre-proline 0 N--CA 1.445 -0.715 0 C-N-CA 125.13 1.372 . . . . 0.0 110.708 -168.736 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -67.42 111.12 2.22 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 N-CA-C 104.574 -2.895 . . . . 0.0 104.574 165.306 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 36.4 mmtm -39.43 -40.54 0.84 Allowed 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 116.753 2.131 . . . . 0.0 116.753 -165.448 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.5 -11.81 11.28 Favored Glycine 0 CA--C 1.536 1.398 0 C-N-CA 124.679 1.133 . . . . 0.0 114.303 176.259 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 31.9 tpt85 -52.52 -33.83 47.06 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 127.072 2.149 . . . . 0.0 111.675 169.168 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.0 t -140.71 140.75 34.94 Favored 'General case' 0 N--CA 1.44 -0.966 0 CA-C-O 122.424 1.107 . . . . 0.0 111.703 -167.653 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 8.8 t -70.34 -54.27 19.26 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 CA-C-N 113.828 -1.533 . . . . 0.0 108.781 179.078 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 7.0 m -61.48 -38.05 79.19 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-O 119.211 -0.423 . . . . 0.0 110.376 -178.189 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' CYS . . . . . 0.467 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 11.9 t -67.32 -37.73 83.79 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.378 1.071 . . . . 0.0 109.93 176.67 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 45.2 m -64.97 -27.04 68.57 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.817 -0.552 . . . . 0.0 110.649 172.218 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -71.36 -26.84 72.61 Favored Glycine 0 C--N 1.344 0.993 0 CA-C-O 121.74 0.633 . . . . 0.0 112.136 169.485 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.544 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 0.2 OUTLIER -82.04 -48.18 11.73 Favored 'General case' 0 N--CA 1.432 -1.34 0 C-N-CA 126.059 1.744 . . . . 0.0 115.074 -167.153 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -64.65 -16.04 62.19 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-O 118.732 -0.651 . . . . 0.0 110.794 172.292 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.85 -46.57 16.62 Favored 'General case' 0 C--N 1.347 0.461 0 C-N-CA 123.905 0.882 . . . . 0.0 109.064 165.29 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.2 tp10 -53.32 -34.51 57.73 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.993 0.917 . . . . 0.0 111.061 175.105 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -60.25 -36.54 77.99 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.931 1.692 . . . . 0.0 111.542 175.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -67.69 -31.03 70.72 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.71 0.804 . . . . 0.0 110.881 176.441 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -70.31 -48.51 56.31 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 169.226 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -65.49 -32.93 74.8 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 124.056 0.943 . . . . 0.0 112.401 -169.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 4.1 pp -64.55 -9.88 22.16 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 175.022 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 27.0 p -83.9 -52.25 6.51 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 123.849 0.86 . . . . 0.0 109.115 168.454 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 9.3 mtp180 -58.7 -66.07 0.56 Allowed 'General case' 0 C--N 1.343 0.326 0 C-N-CA 126.982 2.113 . . . . 0.0 110.408 -179.184 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 26.0 mtmt -82.46 73.47 9.5 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 105.34 -2.096 . . . . 0.0 105.34 168.869 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.5 m -55.4 141.38 36.52 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.225 1.01 . . . . 0.0 112.148 -168.435 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . 44.59 42.96 6.15 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.368 1.467 . . . . 0.0 112.113 -176.158 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 30.3 m -162.48 -171.45 2.78 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 126.823 2.049 . . . . 0.0 107.375 179.044 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 49.3 mtpt . . . . . 0 CA--C 1.535 0.396 0 O-C-N 121.22 -0.925 . . . . 0.0 109.564 178.855 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.2 mtm . . . . . 0 C--O 1.239 0.535 0 CA-C-O 118.391 -0.814 . . . . 0.0 109.131 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -77.44 60.68 7.15 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 C-N-CA 124.464 3.443 . . . . 0.0 111.232 -178.062 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -62.62 -36.99 84.54 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 126.243 1.817 . . . . 0.0 110.912 -176.172 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.0 mtpp -72.84 75.59 1.15 Allowed 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 168.795 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -97.82 103.58 17.63 Favored Pre-proline 0 CA--C 1.541 0.63 0 C-N-CA 127.306 2.243 . . . . 0.0 109.977 -169.134 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -55.15 -32.02 78.19 Favored 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 124.37 3.38 . . . . 0.0 113.418 -176.134 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 66.3 m -98.53 -10.98 22.7 Favored 'General case' 0 N--CA 1.437 -1.099 0 C-N-CA 125.929 1.692 . . . . 0.0 113.36 -168.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 20.2 tp60 -64.09 -25.91 68.31 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 118.614 0.643 . . . . 0.0 111.126 -179.104 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -59.34 -55.78 30.43 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.016 0.926 . . . . 0.0 109.54 169.666 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -63.92 -36.05 82.67 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.539 0.735 . . . . 0.0 110.126 -177.406 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -60.46 -39.16 86.57 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 124.047 0.939 . . . . 0.0 112.065 174.095 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 70.9 m -58.18 -44.76 88.19 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 118.494 0.588 . . . . 0.0 110.553 171.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 30.4 mm-40 -64.58 -22.68 67.04 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 117.745 -1.122 . . . . 0.0 112.393 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.424 HD13 HG13 ' A' ' 31' ' ' VAL . 43.8 mm -58.55 -55.14 24.65 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.263 0 CA-C-N 120.377 1.444 . . . . 0.0 109.302 171.161 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -60.31 -53.04 62.39 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 -177.522 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 16.0 mtpp -68.12 -30.74 69.97 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 118.264 -0.874 . . . . 0.0 111.495 -174.011 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.8 t -58.49 -47.77 83.01 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 119.412 1.005 . . . . 0.0 108.657 168.808 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.74 -46.96 83.75 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 123.235 0.614 . . . . 0.0 110.178 179.555 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -57.42 -44.67 84.82 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.777 0.831 . . . . 0.0 111.39 173.741 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.72 -13.21 61.06 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 174.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 45.2 m-80 -124.25 8.46 8.51 Favored 'General case' 0 C--N 1.343 0.284 0 C-N-CA 124.515 1.126 . . . . 0.0 112.304 -172.129 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.1 m 59.0 40.31 22.47 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 122.44 1.115 . . . . 0.0 110.807 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.272 7.1 m-85 72.11 14.48 5.66 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 127.697 2.399 . . . . 0.0 114.649 168.636 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 60.7 mtm -69.38 84.64 0.4 Allowed 'General case' 0 N--CA 1.441 -0.875 0 C-N-CA 125.403 1.481 . . . . 0.0 110.218 169.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 51.3 tt0 -54.0 -23.18 12.45 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.066 1.347 . . . . 0.0 111.955 169.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.7 m -58.61 -47.59 83.84 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 126.114 1.765 . . . . 0.0 111.699 169.458 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.4 mmtm -64.64 -47.95 76.63 Favored 'General case' 0 C--N 1.342 0.244 0 C-N-CA 124.095 0.958 . . . . 0.0 108.897 175.283 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 71.5 m -68.95 2.13 2.9 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 124.601 1.16 . . . . 0.0 113.186 -179.125 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -54.58 -27.62 40.25 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 119.826 1.194 . . . . 0.0 111.598 167.11 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.62 -54.66 43.94 Favored 'General case' 0 C--N 1.344 0.354 0 C-N-CA 124.747 1.219 . . . . 0.0 111.936 172.155 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.424 HG13 HD13 ' A' ' 14' ' ' ILE . 10.0 p -77.62 -30.58 16.93 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.738 0 C-N-CA 123.483 0.713 . . . . 0.0 110.192 -173.664 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.635 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 57.9 mt -63.54 -42.26 95.52 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 169.563 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.99 -40.47 66.96 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-N 119.981 1.264 . . . . 0.0 111.547 169.879 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -70.08 -39.82 75.36 Favored 'General case' 0 N--CA 1.435 -1.222 0 C-N-CA 118.975 -1.09 . . . . 0.0 110.345 -178.343 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.503 HD13 ' CD1' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -71.3 -27.68 63.58 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 123.654 0.782 . . . . 0.0 110.046 179.378 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.596 HH11 HG22 ' A' ' 32' ' ' ILE . 0.3 OUTLIER -62.25 -59.09 5.53 Favored 'General case' 0 CA--C 1.519 -0.227 0 C-N-CA 126.616 1.967 . . . . 0.0 107.714 172.053 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 58.0 mttm -59.04 -38.99 80.62 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 114.489 -1.232 . . . . 0.0 110.462 -178.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 43.7 t -59.25 -54.23 49.25 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 123.79 0.836 . . . . 0.0 108.955 172.093 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 47.3 t -60.42 -42.58 96.3 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 121.593 0.711 . . . . 0.0 111.922 -173.345 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.44 -3.35 11.04 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.787 1.235 . . . . 0.0 113.466 -179.358 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.563 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 20.7 tt0 -84.39 -9.48 58.38 Favored 'General case' 0 N--CA 1.44 -0.959 0 C-N-CA 124.381 1.073 . . . . 0.0 111.019 178.203 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.563 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 71.6 m-85 -140.37 160.98 57.53 Favored Pre-proline 0 N--CA 1.446 -0.671 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -166.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -69.66 125.83 12.66 Favored 'Trans proline' 0 N--CA 1.457 -0.633 0 N-CA-C 105.312 -2.611 . . . . 0.0 105.312 164.399 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 37.8 mmtt -52.91 -31.38 39.56 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 115.362 1.616 . . . . 0.0 115.362 -165.365 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.12 -13.16 26.45 Favored Glycine 0 CA--C 1.535 1.315 0 C-N-CA 124.014 0.816 . . . . 0.0 113.975 175.765 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.595 HH11 ' HG3' ' A' ' 46' ' ' ARG . 3.9 tpm_? -65.48 -15.38 62.59 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.481 1.912 . . . . 0.0 112.748 169.791 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.1 t -153.26 137.57 16.61 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 120.095 1.316 . . . . 0.0 112.612 -173.782 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 20.4 t -68.26 -55.65 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.658 0 CA-C-N 113.784 -1.553 . . . . 0.0 108.813 174.695 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 7.5 m -61.26 -43.65 96.91 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 CA-C-O 118.881 -0.581 . . . . 0.0 110.079 -174.036 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 11.1 t -63.87 -33.55 75.95 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.776 1.631 . . . . 0.0 110.01 178.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 61.5 m -67.1 -26.2 66.59 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 119.127 -0.463 . . . . 0.0 111.118 172.395 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.77 -33.4 57.89 Favored Glycine 0 C--N 1.345 1.042 0 CA-C-O 123.313 1.507 . . . . 0.0 111.055 167.727 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.635 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 0.7 OUTLIER -78.23 -41.72 33.4 Favored 'General case' 0 N--CA 1.42 -1.932 0 N-CA-C 116.318 1.969 . . . . 0.0 116.318 -164.82 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -65.71 -16.97 64.27 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 118.483 -0.77 . . . . 0.0 111.675 170.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 10.8 mmpt? -80.4 -43.88 20.29 Favored 'General case' 0 C--N 1.345 0.385 0 CA-C-N 119.493 1.042 . . . . 0.0 109.343 166.455 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -57.32 -31.14 65.39 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 118.275 0.488 . . . . 0.0 111.382 173.228 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -61.59 -36.26 80.2 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 124.352 1.061 . . . . 0.0 109.902 178.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -63.79 -39.07 93.35 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 118.392 0.542 . . . . 0.0 110.194 175.318 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 27.4 tp10 -61.04 -52.76 63.59 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.759 0.424 . . . . 0.0 110.885 169.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -70.96 -26.79 63.32 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 118.886 -0.578 . . . . 0.0 112.447 -170.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 28.7 mt -58.24 -22.46 52.3 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 118.638 -0.696 . . . . 0.0 112.273 171.044 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 26.2 p -74.44 -51.32 15.25 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 119.252 0.933 . . . . 0.0 110.183 169.743 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -57.88 -49.24 77.39 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 126.212 1.805 . . . . 0.0 111.081 -178.556 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt -148.71 96.37 2.57 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 127.527 2.331 . . . . 0.0 107.094 -177.48 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 7.6 m -63.79 -21.09 66.26 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 114.237 1.199 . . . . 0.0 114.237 179.437 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.0 32.89 0.08 Allowed 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 129.029 2.931 . . . . 0.0 111.761 167.587 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 22.4 m -68.1 138.76 55.99 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 125.432 1.493 . . . . 0.0 109.803 177.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.7 pttm . . . . . 0 N--CA 1.449 -0.476 0 C-N-CA 125.35 1.46 . . . . 0.0 108.894 -173.206 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.9 mmm . . . . . 0 CA--C 1.539 0.535 0 CA-C-O 118.035 -0.984 . . . . 0.0 109.227 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -50.98 131.83 36.0 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 124.228 3.285 . . . . 0.0 112.883 179.448 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -141.98 -171.27 3.32 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 127.443 2.297 . . . . 0.0 107.688 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.11 124.39 11.4 Favored 'General case' 0 C--N 1.344 0.348 0 N-CA-C 106.027 -1.842 . . . . 0.0 106.027 168.537 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.429 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 40.3 t0 -89.16 106.05 12.21 Favored Pre-proline 0 CA--C 1.543 0.705 0 C-N-CA 123.539 0.736 . . . . 0.0 109.938 -165.297 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.455 ' HD3' ' HE ' ' A' ' 46' ' ' ARG . 23.6 Cg_exo -66.22 -32.04 43.2 Favored 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 125.073 3.849 . . . . 0.0 112.593 -174.499 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.453 ' HB3' ' CD2' ' A' ' 35' ' ' LEU . 99.1 m -93.85 -16.05 24.46 Favored 'General case' 0 N--CA 1.437 -1.075 0 C-N-CA 124.78 1.232 . . . . 0.0 112.562 -167.947 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 20.7 tp60 -59.67 -25.56 64.83 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 123.731 0.812 . . . . 0.0 111.114 177.285 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 51.5 tttm -61.03 -57.27 13.28 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.629 1.172 . . . . 0.0 110.097 168.537 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -61.64 -40.24 94.21 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.687 0.795 . . . . 0.0 110.392 -176.437 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.01 -45.89 52.33 Favored 'General case' 0 C--N 1.341 0.204 0 C-N-CA 125.334 1.454 . . . . 0.0 112.226 169.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 86.4 m -59.54 -45.46 91.72 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.738 -0.21 . . . . 0.0 110.642 175.517 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -60.4 -30.68 69.75 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 118.534 -0.746 . . . . 0.0 111.529 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.1 mt -64.8 -49.56 79.5 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.568 0 CA-C-N 119.451 1.023 . . . . 0.0 110.316 177.362 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.8 mm-40 -54.66 -56.06 23.12 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 124.118 0.886 . . . . 0.0 109.127 176.214 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 7.9 mptt -66.02 -33.29 75.48 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 119.592 -0.843 . . . . 0.0 111.878 -176.369 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 13.1 t -54.11 -49.16 69.77 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-N 119.22 0.918 . . . . 0.0 108.536 168.689 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.55 -47.49 84.06 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 123.878 0.871 . . . . 0.0 110.126 179.022 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -56.23 -46.94 79.33 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.603 0.761 . . . . 0.0 111.223 174.385 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.35 -13.2 60.24 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.1 0.96 . . . . 0.0 113.556 176.091 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -121.68 8.02 10.02 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.674 1.19 . . . . 0.0 111.989 -173.662 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 59.12 40.18 22.18 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 122.392 1.091 . . . . 0.0 110.694 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.265 7.5 m-85 72.05 14.72 5.69 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 127.911 2.485 . . . . 0.0 114.635 168.928 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 63.5 mtm -68.82 85.44 0.32 Allowed 'General case' 0 N--CA 1.44 -0.964 0 C-N-CA 125.086 1.354 . . . . 0.0 110.117 169.721 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -55.54 -19.31 9.53 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.568 1.147 . . . . 0.0 111.456 169.04 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.6 m -59.28 -40.71 86.99 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 127.314 2.246 . . . . 0.0 112.1 169.105 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.2 mmtm -73.33 -47.13 45.05 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 124.409 1.084 . . . . 0.0 108.764 175.155 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 76.3 m -73.53 6.82 2.75 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 125.211 1.404 . . . . 0.0 112.458 -177.659 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.605 HE22 ' NH2' ' A' ' 63' ' ' ARG . 61.5 mm-40 -53.85 -37.42 63.64 Favored 'General case' 0 C--N 1.341 0.206 0 O-C-N 120.858 -1.151 . . . . 0.0 110.601 167.464 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.32 -51.33 69.97 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.919 0.888 . . . . 0.0 111.706 179.132 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 5.8 p -75.69 -26.34 17.99 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.775 0 C-N-CA 123.084 0.554 . . . . 0.0 110.199 -176.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.563 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 58.2 mt -62.22 -49.79 82.61 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 167.75 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.615 HE21 ' NH2' ' A' ' 36' ' ' ARG . 2.0 tt0 -54.87 -33.26 61.71 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 118.962 0.801 . . . . 0.0 111.66 175.37 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -68.6 -41.81 79.07 Favored 'General case' 0 N--CA 1.441 -0.918 0 CA-C-O 119.024 -0.512 . . . . 0.0 111.87 174.04 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.49 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.6 mt -63.57 -37.1 86.04 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 117.203 -1.38 . . . . 0.0 110.984 173.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.615 ' NH2' HE21 ' A' ' 33' ' ' GLN . 2.1 ptt180 -69.1 -40.93 78.09 Favored 'General case' 0 C--N 1.344 0.328 0 CA-C-N 120.625 1.557 . . . . 0.0 109.952 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -63.07 -41.48 99.45 Favored 'General case' 0 C--N 1.341 0.235 0 CA-C-O 119.457 -0.306 . . . . 0.0 111.17 175.34 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.1 t -57.42 -51.69 68.39 Favored 'General case' 0 C--O 1.22 -0.483 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 172.186 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.3 t -58.87 -48.3 81.87 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 124.417 1.087 . . . . 0.0 111.879 -172.208 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.78 -1.23 6.61 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.243 -0.89 . . . . 0.0 112.781 -177.229 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.545 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 20.1 tt0 -80.98 -10.96 59.65 Favored 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 124.208 1.003 . . . . 0.0 110.893 175.372 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.545 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 83.6 m-85 -135.07 157.88 76.0 Favored Pre-proline 0 N--CA 1.445 -0.715 0 C-N-CA 125.304 1.442 . . . . 0.0 110.807 -168.578 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -67.57 105.75 1.14 Allowed 'Trans proline' 0 N--CA 1.455 -0.783 0 N-CA-C 104.671 -2.857 . . . . 0.0 104.671 166.324 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 22.5 pttp -39.14 -38.74 0.51 Allowed 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 117.895 2.554 . . . . 0.0 117.895 -164.533 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.02 -15.09 19.69 Favored Glycine 0 CA--C 1.536 1.379 0 CA-C-N 119.365 0.984 . . . . 0.0 114.04 175.77 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.455 ' HE ' ' HD3' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -57.5 -27.44 62.54 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 126.281 1.833 . . . . 0.0 112.853 170.06 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.8 t -134.95 137.44 43.1 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-O 122.663 1.22 . . . . 0.0 110.865 -173.1 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 21.6 t -70.66 -55.9 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 CA-C-N 113.904 -1.498 . . . . 0.0 108.797 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 9.7 m -58.44 -43.02 85.77 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 CA-C-O 119.203 -0.427 . . . . 0.0 110.004 -178.616 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' CYS . . . . . 0.459 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 11.4 t -64.67 -35.67 81.78 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.764 1.625 . . . . 0.0 110.1 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 52.5 m -66.02 -25.5 67.09 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 118.959 -0.543 . . . . 0.0 110.921 172.751 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.42 -40.32 54.92 Favored Glycine 0 C--N 1.344 0.987 0 CA-C-O 123.935 1.853 . . . . 0.0 110.719 167.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.563 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 0.5 OUTLIER -69.45 -40.5 77.14 Favored 'General case' 0 N--CA 1.421 -1.924 0 C-N-CA 126.136 1.774 . . . . 0.0 115.564 -166.319 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -66.4 -16.96 64.5 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 118.704 -0.665 . . . . 0.0 111.507 174.501 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 47.6 mttp -80.54 -44.93 18.24 Favored 'General case' 0 C--N 1.347 0.463 0 CA-C-N 119.329 0.968 . . . . 0.0 109.306 166.42 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -58.97 -28.54 66.41 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 117.986 0.357 . . . . 0.0 111.82 173.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -61.45 -34.94 76.27 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.636 1.174 . . . . 0.0 109.844 177.087 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.3 tm-20 -61.18 -45.73 93.4 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 118.581 0.628 . . . . 0.0 109.393 173.13 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -56.03 -53.04 61.75 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 117.838 0.29 . . . . 0.0 110.655 171.558 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -68.73 -29.13 67.48 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 122.958 0.503 . . . . 0.0 111.997 -170.282 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 34.8 mt -62.02 -24.13 66.86 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.889 0.876 . . . . 0.0 112.46 169.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 29.6 p -83.99 -43.95 14.66 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 119.659 1.118 . . . . 0.0 110.687 169.703 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.605 ' NH2' HE22 ' A' ' 29' ' ' GLN . 23.6 ttp180 -66.33 -25.73 66.96 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.76 1.624 . . . . 0.0 112.909 -177.192 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 62.7 mtpt 51.46 35.96 15.56 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 129.025 2.93 . . . . 0.0 113.699 172.235 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 5.7 p -69.02 146.88 52.31 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 123.126 0.57 . . . . 0.0 111.127 173.077 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -135.48 140.16 44.61 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 126.281 1.832 . . . . 0.0 107.823 176.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 29.1 m -174.76 -166.48 0.25 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 126.755 2.022 . . . . 0.0 108.674 -173.014 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 58.6 pttt . . . . . 0 CA--C 1.533 0.322 0 C-N-CA 124.549 1.14 . . . . 0.0 110.896 172.889 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 88.4 mmm . . . . . 0 CA--C 1.539 0.522 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -49.52 128.7 21.38 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 123.33 2.687 . . . . 0.0 111.373 174.466 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 19.4 mm100 -70.7 70.12 0.45 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.895 1.678 . . . . 0.0 110.996 -179.501 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.6 ptpt -71.95 -170.18 0.55 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 126.768 2.027 . . . . 0.0 109.488 168.273 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -139.78 88.31 12.27 Favored Pre-proline 0 CA--C 1.536 0.406 0 O-C-N 121.213 -0.929 . . . . 0.0 108.827 168.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -57.19 -31.06 89.46 Favored 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 124.039 3.159 . . . . 0.0 112.901 -175.363 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 54.7 m -94.27 -10.47 32.76 Favored 'General case' 0 N--CA 1.437 -1.108 0 C-N-CA 125.362 1.465 . . . . 0.0 113.052 -169.833 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 27.7 tp60 -63.21 -24.54 67.92 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 118.447 0.567 . . . . 0.0 111.256 -179.249 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.6 tppt? -60.48 -53.76 53.65 Favored 'General case' 0 C--N 1.339 0.132 0 C-N-CA 122.991 0.517 . . . . 0.0 109.97 169.276 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -62.49 -39.66 94.2 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.551 0.741 . . . . 0.0 110.004 -177.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -53.97 -45.9 71.52 Favored 'General case' 0 C--N 1.343 0.308 0 C-N-CA 125.044 1.338 . . . . 0.0 112.34 169.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 67.6 m -57.92 -42.76 85.47 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 121.333 -0.147 . . . . 0.0 110.786 174.147 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -65.04 -22.7 67.02 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-O 117.604 -1.189 . . . . 0.0 112.706 178.216 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 27.8 mm -59.41 -52.83 56.25 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.244 0 CA-C-N 120.515 1.507 . . . . 0.0 108.962 172.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 33.7 mm-40 -58.34 -53.97 52.24 Favored 'General case' 0 N--CA 1.442 -0.828 0 O-C-N 123.989 0.806 . . . . 0.0 109.051 178.344 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 57.1 mmtt -68.17 -30.93 70.15 Favored 'General case' 0 N--CA 1.457 -0.078 0 C-N-CA 118.507 -1.277 . . . . 0.0 111.555 -173.254 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 19.4 t -56.85 -48.73 77.41 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 168.709 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.93 -46.73 84.59 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 123.203 0.601 . . . . 0.0 110.53 179.353 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -57.16 -45.78 83.32 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.751 0.821 . . . . 0.0 111.231 174.084 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.98 -12.47 55.22 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 175.216 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -124.38 8.56 8.43 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.695 1.198 . . . . 0.0 112.387 -172.684 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 58.49 40.1 24.3 Favored 'General case' 0 C--N 1.345 0.393 0 CA-C-O 122.418 1.104 . . . . 0.0 110.913 179.445 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.259 7.0 m-85 71.88 13.7 6.02 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 127.826 2.45 . . . . 0.0 114.692 168.819 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 66.0 mtm -69.98 85.59 0.52 Allowed 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 125.051 1.34 . . . . 0.0 109.791 170.115 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -54.04 -24.93 18.89 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.283 0.633 . . . . 0.0 111.504 171.201 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.2 m -52.63 -40.33 62.66 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 126.293 1.837 . . . . 0.0 112.297 170.719 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.1 mmtm -71.79 -46.42 58.37 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.212 1.005 . . . . 0.0 108.794 174.218 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.7 m -74.67 5.29 5.03 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 124.749 1.219 . . . . 0.0 113.222 -173.618 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 -57.66 -26.8 62.18 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 119.196 0.907 . . . . 0.0 110.674 166.555 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.55 -55.7 31.18 Favored 'General case' 0 C--N 1.346 0.446 0 C-N-CA 126.21 1.804 . . . . 0.0 111.709 171.806 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.6 p -76.07 -27.02 17.75 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.69 0 C-N-CA 123.693 0.797 . . . . 0.0 109.759 -175.371 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 26.4 mt -62.41 -45.9 97.68 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 168.086 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -52.13 -36.9 52.65 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 118.755 0.707 . . . . 0.0 111.265 171.698 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -71.55 -43.38 66.49 Favored 'General case' 0 N--CA 1.433 -1.311 0 CA-C-O 118.633 -0.699 . . . . 0.0 111.678 178.568 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.496 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.3 mt -63.37 -31.73 72.96 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 119.637 1.108 . . . . 0.0 110.668 173.988 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.456 HH11 ' HG3' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -60.67 -58.47 8.32 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.495 1.118 . . . . 0.0 108.783 177.363 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 55.9 mtpt -62.32 -35.64 79.7 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 113.862 -1.517 . . . . 0.0 111.143 -178.615 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 41.8 t -60.9 -51.83 67.6 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 170.542 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 51.5 t -62.79 -49.16 76.08 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 123.406 0.682 . . . . 0.0 111.647 -170.785 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.05 -1.39 5.79 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.111 -0.95 . . . . 0.0 112.551 -177.035 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.435 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 2.2 tp-100 -84.5 -7.18 59.36 Favored 'General case' 0 N--CA 1.435 -1.194 0 C-N-CA 124.735 1.214 . . . . 0.0 111.476 177.298 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.435 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 72.9 m-85 -139.67 160.72 60.09 Favored Pre-proline 0 N--CA 1.446 -0.644 0 C-N-CA 124.705 1.202 . . . . 0.0 111.23 -169.43 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -67.29 120.14 7.19 Favored 'Trans proline' 0 N--CA 1.455 -0.788 0 N-CA-C 105.36 -2.592 . . . . 0.0 105.36 165.295 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -47.73 -32.11 5.49 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 116.086 1.884 . . . . 0.0 116.086 -167.133 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.33 -15.12 36.88 Favored Glycine 0 CA--C 1.536 1.364 0 CA-C-N 118.782 0.719 . . . . 0.0 113.769 176.735 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.89 -11.41 46.76 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 126.055 1.742 . . . . 0.0 112.419 170.058 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.0 t -153.74 136.75 15.49 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-O 123.104 1.43 . . . . 0.0 113.058 -178.498 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.0 t -70.52 -53.51 22.28 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 CA-C-N 113.463 -1.699 . . . . 0.0 108.798 176.269 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.9 m -59.73 -41.69 86.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-O 119.264 -0.398 . . . . 0.0 110.029 -178.133 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' CYS . . . . . 0.447 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 10.7 t -64.42 -37.45 87.57 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.51 1.524 . . . . 0.0 110.16 177.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 48.8 m -66.17 -23.58 66.49 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 118.949 -0.548 . . . . 0.0 111.264 173.793 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -77.01 -25.85 63.44 Favored Glycine 0 C--N 1.346 1.089 0 CA-C-O 123.194 1.441 . . . . 0.0 111.781 168.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.496 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -81.67 -41.67 21.05 Favored 'General case' 0 N--CA 1.428 -1.538 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 -166.114 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -68.17 -23.52 64.87 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 119.174 -0.441 . . . . 0.0 110.647 171.334 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 17.3 tppt? -69.73 -44.68 69.78 Favored 'General case' 0 C--N 1.345 0.398 0 CA-C-N 118.888 0.767 . . . . 0.0 109.25 167.024 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -59.57 -31.8 69.78 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 118.807 0.731 . . . . 0.0 111.754 170.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -66.08 -55.63 15.56 Favored 'General case' 0 N--CA 1.456 -0.155 0 O-C-N 120.754 -1.216 . . . . 0.0 108.42 175.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -55.23 -36.56 66.14 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.518 0.727 . . . . 0.0 111.522 177.002 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -56.83 -58.32 8.63 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 124.703 1.201 . . . . 0.0 109.962 174.668 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 49.6 m-80 -75.08 -28.1 60.18 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -170.721 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 60.8 mt -56.47 -22.46 32.57 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 118.215 -0.898 . . . . 0.0 112.818 170.156 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 52.4 p -64.6 -47.28 79.24 Favored 'General case' 0 C--N 1.344 0.329 0 CA-C-N 119.919 1.236 . . . . 0.0 110.885 171.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.37 -57.67 8.67 Favored 'General case' 0 C--N 1.338 0.091 0 C-N-CA 124.247 1.019 . . . . 0.0 110.901 177.134 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.7 tppp? -158.33 157.59 32.69 Favored 'General case' 0 C--O 1.224 -0.249 0 C-N-CA 122.916 0.486 . . . . 0.0 110.042 -175.329 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 5.6 m -64.07 -18.74 64.67 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 115.056 1.502 . . . . 0.0 115.056 176.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -63.97 115.79 5.23 Favored 'General case' 0 C--N 1.317 -0.804 0 C-N-CA 128.276 2.631 . . . . 0.0 109.547 170.689 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 5.6 p -68.5 42.11 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 127.799 2.44 . . . . 0.0 113.928 -177.568 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 20.5 pttp . . . . . 0 CA--C 1.539 0.52 0 O-C-N 120.264 -1.522 . . . . 0.0 111.695 174.789 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.7 mtm . . . . . 0 CA--C 1.54 0.56 0 CA-C-O 118.817 -0.611 . . . . 0.0 110.054 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -73.18 69.3 3.99 Favored 'Trans proline' 0 CA--C 1.539 0.725 0 C-N-CA 124.534 3.49 . . . . 0.0 110.482 173.829 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 -64.28 -29.17 70.27 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.705 1.602 . . . . 0.0 111.769 -174.912 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 18.4 ptmt -72.78 65.72 0.72 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.12 1.368 . . . . 0.0 109.341 168.66 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -94.57 105.34 17.78 Favored Pre-proline 0 CA--C 1.541 0.599 0 C-N-CA 128.02 2.528 . . . . 0.0 110.993 -167.6 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -55.08 -31.93 77.26 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 124.177 3.251 . . . . 0.0 113.228 -178.737 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 84.4 m -96.77 -11.01 25.54 Favored 'General case' 0 N--CA 1.438 -1.073 0 C-N-CA 126.013 1.725 . . . . 0.0 113.6 -169.354 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.1 tp60 -64.12 -26.03 68.36 Favored 'General case' 0 N--CA 1.444 -0.775 0 CA-C-N 118.294 0.497 . . . . 0.0 110.721 -179.158 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.6 tptt -59.91 -56.11 25.84 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.537 0.735 . . . . 0.0 109.811 169.395 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -60.72 -39.7 89.58 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.117 0.567 . . . . 0.0 109.932 -177.192 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.43 -41.81 85.89 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.991 1.316 . . . . 0.0 112.451 171.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 98.3 m -59.71 -44.13 93.82 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.673 0.67 . . . . 0.0 110.627 171.898 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -64.97 -20.11 66.32 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 117.69 -1.148 . . . . 0.0 112.44 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 29.6 mm -59.04 -54.09 38.93 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 CA-C-N 120.538 1.517 . . . . 0.0 109.186 170.09 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 6.7 mm-40 -60.49 -53.38 58.27 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 -178.602 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 24.6 mttm -68.0 -30.29 69.51 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 118.222 -0.894 . . . . 0.0 111.583 -173.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 15.7 t -58.28 -47.73 82.69 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 119.386 0.994 . . . . 0.0 108.52 168.785 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.69 -46.83 83.8 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 118.843 -0.599 . . . . 0.0 110.282 178.991 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -57.55 -44.63 85.34 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.558 0.743 . . . . 0.0 111.419 173.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.85 -13.23 61.38 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 175.143 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 -123.67 8.22 8.86 Favored 'General case' 0 C--N 1.343 0.301 0 C-N-CA 124.725 1.21 . . . . 0.0 112.277 -172.365 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.3 m 58.84 40.14 23.16 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 122.37 1.081 . . . . 0.0 110.774 179.715 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.26 7.1 m-85 72.02 13.93 5.83 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 127.816 2.446 . . . . 0.0 114.563 168.681 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 68.1 mtm -70.77 83.27 0.64 Allowed 'General case' 0 N--CA 1.441 -0.881 0 C-N-CA 125.293 1.437 . . . . 0.0 109.777 170.758 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -54.41 -23.57 16.37 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.914 0.886 . . . . 0.0 111.79 172.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 4.3 m -51.98 -42.82 63.24 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 126.096 1.758 . . . . 0.0 111.907 169.815 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 48.4 mmtt -69.54 -48.02 61.79 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 124.559 1.144 . . . . 0.0 108.891 175.204 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.0 m -72.27 1.27 7.99 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 124.584 1.154 . . . . 0.0 113.307 -173.615 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 86.7 mm-40 -55.94 -26.77 49.35 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.477 1.035 . . . . 0.0 111.139 166.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.47 -57.9 10.91 Favored 'General case' 0 C--N 1.347 0.466 0 C-N-CA 125.5 1.52 . . . . 0.0 111.677 171.198 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 14.0 p -74.82 -29.47 22.8 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.76 0 C-N-CA 123.68 0.792 . . . . 0.0 110.145 -173.386 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.433 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 63.8 mt -58.77 -50.83 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.649 0 N-CA-C 105.402 -2.073 . . . . 0.0 105.402 167.863 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.403 ' HA ' ' HG3' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -56.28 -35.48 67.53 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 119.232 0.923 . . . . 0.0 112.869 175.077 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -68.31 -35.31 77.63 Favored 'General case' 0 N--CA 1.438 -1.05 0 C-N-CA 118.995 -1.082 . . . . 0.0 110.027 179.565 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.493 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -65.79 -26.33 67.65 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 125.155 1.382 . . . . 0.0 109.885 173.311 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.403 ' HG3' ' HA ' ' A' ' 33' ' ' GLN . 20.0 mmt85 -71.28 -50.92 27.72 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 177.534 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 67.2 mmtt -65.87 -25.08 67.02 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.247 179.26 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 47.6 t -70.36 -55.17 9.77 Favored 'General case' 0 N--CA 1.441 -0.922 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 167.257 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.3 t -60.27 -46.93 88.1 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 121.234 -0.916 . . . . 0.0 112.656 -170.241 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.12 2.05 6.48 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -175.188 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.57 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 11.6 tt0 -90.36 -8.99 49.34 Favored 'General case' 0 N--CA 1.442 -0.837 0 C-N-CA 126.123 1.769 . . . . 0.0 111.234 -175.681 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.57 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 74.9 m-85 -139.45 160.61 61.01 Favored Pre-proline 0 N--CA 1.445 -0.706 0 C-N-CA 124.637 1.175 . . . . 0.0 111.978 -167.998 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -66.12 127.97 18.64 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 N-CA-C 105.574 -2.51 . . . . 0.0 105.574 165.065 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -53.24 -32.26 47.46 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 114.271 1.211 . . . . 0.0 114.271 -166.732 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.82 -9.13 18.37 Favored Glycine 0 CA--C 1.535 1.343 0 C-N-CA 124.566 1.079 . . . . 0.0 114.236 175.819 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.3 tpm_? -68.44 -17.37 64.19 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 126.172 1.789 . . . . 0.0 112.406 169.759 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.9 t -149.97 137.95 20.25 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 122.641 1.21 . . . . 0.0 113.306 -170.869 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 26.2 t -70.11 -56.35 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 113.536 -1.665 . . . . 0.0 108.726 172.691 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 12.5 m -62.87 -41.72 93.71 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 CA-C-O 118.637 -0.696 . . . . 0.0 110.397 -172.822 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 28.0 t -63.06 -33.81 76.23 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.244 1.418 . . . . 0.0 110.118 176.727 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 56.9 m -67.92 -21.09 65.13 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 118.549 -0.739 . . . . 0.0 111.363 172.413 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -75.38 -39.95 34.56 Favored Glycine 0 C--N 1.344 1.004 0 CA-C-O 124.202 2.001 . . . . 0.0 110.796 166.372 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.493 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 1.2 t80 -73.92 -40.55 63.05 Favored 'General case' 0 N--CA 1.417 -2.097 0 CA-C-N 112.016 -2.092 . . . . 0.0 116.546 -163.859 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -64.01 -25.53 68.17 Favored 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 119.86 -0.736 . . . . 0.0 110.937 170.652 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 39.4 mmtm -72.12 -37.55 69.46 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-N 119.231 0.923 . . . . 0.0 110.036 168.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -58.06 -42.65 85.92 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.041 0.537 . . . . 0.0 110.498 171.085 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -64.88 -41.74 95.4 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 124.277 1.031 . . . . 0.0 110.734 179.107 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -61.01 -43.34 99.03 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 118.199 0.454 . . . . 0.0 110.853 170.85 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -58.99 -38.22 78.65 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 123.584 0.753 . . . . 0.0 111.385 174.406 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -62.08 -30.9 71.31 Favored 'General case' 0 CA--C 1.521 -0.149 0 C-N-CA 123.855 0.862 . . . . 0.0 112.368 -176.032 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 64.3 mt -54.23 -27.2 33.07 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.355 0.662 . . . . 0.0 112.13 170.949 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 29.8 p -94.38 -45.28 7.53 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.619 1.568 . . . . 0.0 110.905 173.322 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 35.5 ttp85 -61.5 -26.7 68.08 Favored 'General case' 0 N--CA 1.461 0.096 0 C-N-CA 125.8 1.64 . . . . 0.0 112.517 -174.03 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.5 pptp? -61.55 4.47 0.1 Allowed 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 116.242 1.941 . . . . 0.0 116.242 176.461 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 13.1 p -74.19 -165.89 0.36 Allowed 'General case' 0 N--CA 1.443 -0.804 0 C-N-CA 128.88 2.872 . . . . 0.0 108.846 167.244 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -61.21 92.83 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.275 1.03 . . . . 0.0 110.948 175.532 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 53.5 p -151.74 -163.48 1.76 Allowed 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.559 1.944 . . . . 0.0 108.905 -179.224 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 29.3 mtmm . . . . . 0 N--CA 1.466 0.339 0 C-N-CA 125.605 1.562 . . . . 0.0 111.809 172.515 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 mpp? . . . . . 0 CA--C 1.54 0.595 0 CA-C-O 119.102 -0.475 . . . . 0.0 109.835 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo -78.4 60.68 7.61 Favored 'Trans proline' 0 CA--C 1.544 0.998 0 C-N-CA 123.633 2.889 . . . . 0.0 111.863 -174.153 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -69.43 83.19 0.39 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 127.356 2.263 . . . . 0.0 110.732 -169.753 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.6 mttt 50.24 16.95 0.29 Allowed 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 128.289 2.635 . . . . 0.0 113.864 -169.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -144.86 98.01 4.86 Favored Pre-proline 0 N--CA 1.439 -0.979 0 C-N-CA 129.98 3.312 . . . . 0.0 104.437 -169.025 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -56.21 -30.04 78.2 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 123.91 3.073 . . . . 0.0 112.702 -169.832 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 69.7 m -94.25 -10.89 31.47 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.56 1.544 . . . . 0.0 112.772 -171.277 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 22.2 tp60 -63.94 -25.09 67.98 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 118.618 0.645 . . . . 0.0 111.045 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 46.3 tttm -59.76 -55.9 28.5 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.624 1.17 . . . . 0.0 110.024 168.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 -65.25 -33.76 76.76 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.016 0.527 . . . . 0.0 110.072 -178.074 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -62.52 -40.27 96.24 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.535 0.734 . . . . 0.0 112.102 172.604 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 74.2 m -59.03 -44.97 91.81 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.411 0.55 . . . . 0.0 110.017 171.045 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -60.05 -28.1 67.49 Favored 'General case' 0 C--O 1.226 -0.133 0 CA-C-O 117.739 -1.124 . . . . 0.0 112.037 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 43.8 mm -57.76 -55.29 22.42 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.248 0 CA-C-N 120.013 1.279 . . . . 0.0 109.703 173.052 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -57.83 -55.15 38.61 Favored 'General case' 0 N--CA 1.444 -0.725 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 -178.862 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.6 mptp? -66.98 -31.99 72.92 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 118.824 -1.151 . . . . 0.0 111.789 -174.852 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 21.2 t -56.14 -48.46 76.21 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 119.532 1.06 . . . . 0.0 108.746 169.191 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.62 -47.02 85.76 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 123.208 0.603 . . . . 0.0 110.5 179.565 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -57.04 -45.79 82.9 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.608 0.763 . . . . 0.0 111.197 174.367 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.71 -13.12 58.65 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.128 0.971 . . . . 0.0 113.406 175.627 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 -123.66 8.89 8.89 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 124.579 1.152 . . . . 0.0 112.197 -173.438 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 57.91 40.31 25.91 Favored 'General case' 0 C--N 1.345 0.41 0 CA-C-O 122.437 1.113 . . . . 0.0 110.989 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.262 6.8 m-85 72.34 13.93 5.5 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 127.803 2.441 . . . . 0.0 114.445 168.848 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 68.5 mtm -70.67 84.51 0.63 Allowed 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 125.118 1.367 . . . . 0.0 109.866 170.622 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -53.89 -24.01 14.62 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.892 0.877 . . . . 0.0 111.679 171.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.7 m -53.37 -40.37 64.94 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.028 1.731 . . . . 0.0 112.304 170.462 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 51.8 mmtt -71.92 -47.48 52.27 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.375 1.07 . . . . 0.0 108.778 174.777 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 71.6 m -72.53 1.89 7.33 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.771 1.229 . . . . 0.0 113.356 -174.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 74.7 mm-40 -54.76 -27.54 41.92 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 119.587 1.085 . . . . 0.0 110.911 167.343 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.47 -57.63 12.14 Favored 'General case' 0 C--N 1.347 0.467 0 C-N-CA 126.011 1.724 . . . . 0.0 111.961 172.48 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.0 p -74.41 -29.73 24.71 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.722 0 C-N-CA 123.712 0.805 . . . . 0.0 109.7 -174.333 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.617 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 72.5 mt -61.74 -45.33 98.92 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 169.207 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.64 -38.73 69.93 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 118.702 0.683 . . . . 0.0 111.914 172.551 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -70.93 -40.22 72.21 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 118.482 -1.287 . . . . 0.0 109.966 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.504 HD13 ' CE1' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -66.13 -26.78 67.6 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.877 0.871 . . . . 0.0 109.786 178.026 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.71 -56.03 12.42 Favored 'General case' 0 CA--C 1.513 -0.443 0 C-N-CA 125.193 1.397 . . . . 0.0 108.578 176.38 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 7.9 mptt -61.01 -32.53 72.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 113.519 -1.673 . . . . 0.0 110.436 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 47.4 t -63.94 -55.97 18.61 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 168.394 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 52.8 t -58.89 -46.54 87.62 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 124.007 0.923 . . . . 0.0 112.457 -170.097 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.87 -3.01 13.9 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.249 -0.887 . . . . 0.0 112.833 -177.406 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.453 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 3.1 tp-100 -86.46 -5.74 59.08 Favored 'General case' 0 N--CA 1.438 -1.052 0 C-N-CA 124.57 1.148 . . . . 0.0 111.71 -177.346 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.453 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 79.5 m-85 -138.2 159.78 66.77 Favored Pre-proline 0 N--CA 1.444 -0.747 0 C-N-CA 124.531 1.132 . . . . 0.0 111.261 -168.652 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -66.97 113.11 2.68 Favored 'Trans proline' 0 N--CA 1.454 -0.845 0 N-CA-C 105.159 -2.67 . . . . 0.0 105.159 165.628 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 39.6 mmtm -42.75 -35.62 1.2 Allowed 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 116.306 1.965 . . . . 0.0 116.306 -166.271 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.68 -15.86 20.56 Favored Glycine 0 CA--C 1.539 1.548 0 C-N-CA 124.629 1.109 . . . . 0.0 114.266 175.188 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.2 tpm_? -58.51 -24.22 59.99 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.745 2.018 . . . . 0.0 111.835 169.484 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 8.1 t -145.2 130.72 18.81 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-O 123.359 1.552 . . . . 0.0 112.787 -169.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.4 t -68.74 -50.71 52.62 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 CA-C-N 112.681 -2.054 . . . . 0.0 108.566 176.577 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.9 m -61.0 -45.37 98.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 CA-C-O 118.555 -0.735 . . . . 0.0 109.592 -178.191 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 24.4 t -61.65 -35.14 77.1 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.299 1.84 . . . . 0.0 110.304 178.59 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.6 m -66.96 -26.34 66.78 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.188 0.595 . . . . 0.0 111.303 172.776 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.84 -30.87 60.9 Favored Glycine 0 C--N 1.344 1.01 0 CA-C-O 123.437 1.576 . . . . 0.0 111.731 168.14 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.617 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 0.6 OUTLIER -81.36 -41.16 22.41 Favored 'General case' 0 N--CA 1.424 -1.733 0 N-CA-C 117.39 2.367 . . . . 0.0 117.39 -164.393 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -65.5 -27.84 68.76 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 118.9 -0.571 . . . . 0.0 109.565 168.717 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 55.6 mttp -70.78 -35.08 72.41 Favored 'General case' 0 C--N 1.348 0.51 0 CA-C-N 119.236 0.926 . . . . 0.0 110.285 167.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.91 -35.15 75.94 Favored 'General case' 0 C--O 1.22 -0.497 0 CA-C-N 119.132 0.878 . . . . 0.0 110.266 169.559 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -63.56 -44.63 93.56 Favored 'General case' 0 CA--C 1.531 0.22 0 O-C-N 120.99 -1.069 . . . . 0.0 110.394 174.62 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -58.92 -40.81 85.7 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 118.644 0.656 . . . . 0.0 110.893 171.638 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -62.15 -40.17 95.07 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.648 0.779 . . . . 0.0 111.387 173.774 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -63.01 -42.96 99.95 Favored 'General case' 0 CA--C 1.529 0.158 0 O-C-N 120.848 -1.158 . . . . 0.0 109.743 175.255 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 80.9 mt -64.22 -43.18 95.78 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 123.184 0.593 . . . . 0.0 110.199 -178.42 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.06 -39.54 90.18 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 119.479 -0.296 . . . . 0.0 110.577 174.852 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 10.8 mmp_? -67.52 -29.62 69.07 Favored 'General case' 0 C--N 1.342 0.259 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 179.662 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 81.3 mttt -69.38 47.46 0.07 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.631 1.572 . . . . 0.0 110.943 168.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 59.7 p -145.33 175.92 9.94 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 127.121 2.169 . . . . 0.0 109.044 174.411 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -63.61 72.81 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 127.075 2.15 . . . . 0.0 112.207 -177.437 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 49.6 m -80.82 63.65 5.3 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 126.667 1.987 . . . . 0.0 110.741 -169.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 59.3 mtmt . . . . . 0 N--CA 1.465 0.31 0 C-N-CA 125.184 1.394 . . . . 0.0 110.685 -178.552 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.0 mtt . . . . . 0 C--O 1.239 0.523 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -63.75 159.09 43.08 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.368 2.045 . . . . 0.0 110.321 172.803 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 96.0 mm-40 -129.41 163.03 26.71 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 125.359 1.463 . . . . 0.0 110.281 -169.119 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 22.8 ptmt -145.78 -178.57 6.17 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 125.18 1.392 . . . . 0.0 110.201 178.065 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -135.69 88.75 23.08 Favored Pre-proline 0 CA--C 1.538 0.481 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 168.557 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -60.27 -32.9 94.86 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 123.747 2.965 . . . . 0.0 112.802 -171.208 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 96.3 m -94.14 -12.19 28.9 Favored 'General case' 0 N--CA 1.437 -1.099 0 C-N-CA 124.475 1.11 . . . . 0.0 113.144 -168.614 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 18.8 tp60 -61.38 -26.79 68.07 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 122.756 0.422 . . . . 0.0 110.833 177.762 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 51.9 tptt -60.05 -57.7 11.69 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.451 0.7 . . . . 0.0 109.807 168.901 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -60.28 -37.52 80.73 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 122.983 0.513 . . . . 0.0 110.317 -176.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -60.43 -35.82 76.73 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.465 1.106 . . . . 0.0 113.037 172.759 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 75.8 m -64.07 -44.49 92.23 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 118.343 0.52 . . . . 0.0 110.396 169.351 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.4 mm-40 -64.1 -25.09 67.95 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 117.955 -1.022 . . . . 0.0 112.28 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.418 HD13 HG13 ' A' ' 31' ' ' VAL . 46.8 mm -56.44 -50.5 72.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.243 0 CA-C-N 119.964 1.256 . . . . 0.0 109.409 169.251 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 -60.78 -55.39 33.74 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 -175.543 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 48.1 mttt -69.94 -30.58 68.0 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 118.245 -0.884 . . . . 0.0 111.425 -172.289 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 17.3 t -57.14 -46.76 82.42 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 168.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.05 -45.95 89.48 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 118.49 -0.767 . . . . 0.0 110.354 179.025 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -58.28 -45.27 88.21 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 119.177 0.899 . . . . 0.0 111.282 174.235 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.07 -13.53 58.21 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.048 0.939 . . . . 0.0 113.306 175.595 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -124.38 9.04 8.46 Favored 'General case' 0 C--N 1.343 0.289 0 C-N-CA 124.425 1.09 . . . . 0.0 112.351 -172.737 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.6 m 57.83 40.45 26.04 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 122.464 1.126 . . . . 0.0 110.814 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.256 6.8 m-85 72.01 13.98 5.84 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 127.852 2.461 . . . . 0.0 114.44 168.781 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 66.1 mtm -70.23 85.6 0.57 Allowed 'General case' 0 N--CA 1.44 -0.931 0 C-N-CA 125.132 1.373 . . . . 0.0 109.723 169.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -53.37 -25.69 16.45 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.312 0.645 . . . . 0.0 111.381 170.213 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.1 m -52.31 -38.86 59.62 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 126.744 2.018 . . . . 0.0 112.675 170.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.7 mmtm -74.17 -47.51 35.33 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.369 1.068 . . . . 0.0 108.69 173.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.2 m -71.71 0.89 7.72 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 124.892 1.277 . . . . 0.0 113.281 -174.496 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 51.6 mm-40 -54.72 -28.26 46.8 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 119.652 1.114 . . . . 0.0 110.242 166.905 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.59 -56.65 19.44 Favored 'General case' 0 C--N 1.346 0.441 0 C-N-CA 125.789 1.636 . . . . 0.0 111.906 171.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.418 HG13 HD13 ' A' ' 14' ' ' ILE . 13.4 p -75.77 -28.34 19.31 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.835 0 C-N-CA 123.288 0.635 . . . . 0.0 110.002 -174.113 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.478 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 60.0 mt -61.91 -45.85 97.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 N-CA-C 106.564 -1.643 . . . . 0.0 106.564 168.725 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.92 -38.41 70.24 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 119.202 0.91 . . . . 0.0 112.284 171.129 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -70.26 -37.85 74.98 Favored 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 119.354 -0.938 . . . . 0.0 110.085 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.551 HD13 ' CE1' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -65.28 -30.81 71.71 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 124.673 1.189 . . . . 0.0 108.834 174.957 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.0 mmt-85 -69.96 -49.89 47.31 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -61.02 -35.43 76.85 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-N 114.895 -1.048 . . . . 0.0 110.698 177.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 51.0 t -61.81 -57.17 12.89 Favored 'General case' 0 C--O 1.219 -0.551 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 168.748 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 35.4 t -58.39 -44.29 88.89 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 123.856 0.862 . . . . 0.0 112.144 -169.535 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.41 -1.21 10.01 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 124.03 0.932 . . . . 0.0 113.296 -178.327 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.555 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 15.5 tt0 -83.87 -8.85 59.1 Favored 'General case' 0 N--CA 1.444 -0.764 0 C-N-CA 124.435 1.094 . . . . 0.0 111.105 176.902 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.555 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 90.6 m-85 -138.97 158.02 70.49 Favored Pre-proline 0 N--CA 1.441 -0.894 0 C-N-CA 124.979 1.312 . . . . 0.0 112.106 -166.891 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -69.86 111.06 2.73 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 N-CA-C 104.968 -2.743 . . . . 0.0 104.968 165.163 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 64.3 pttt -42.01 -32.57 0.46 Allowed 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 117.964 2.579 . . . . 0.0 117.964 -166.279 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -56.47 -15.76 12.95 Favored Glycine 0 CA--C 1.538 1.509 0 CA-C-N 119.468 1.031 . . . . 0.0 114.177 172.68 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 5.0 tpm_? -54.05 -24.74 18.31 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 127.583 2.353 . . . . 0.0 112.132 168.605 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.3 t -146.76 137.74 24.05 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-O 122.73 1.252 . . . . 0.0 111.82 -170.392 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 18.7 t -66.84 -53.71 31.98 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.677 0 CA-C-N 113.491 -1.686 . . . . 0.0 108.487 177.172 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 3.8 m -60.26 -46.08 95.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-O 118.47 -0.776 . . . . 0.0 109.415 -178.721 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 41.9 t -63.31 -30.22 71.39 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.125 1.37 . . . . 0.0 109.943 -178.258 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 52.3 m -68.45 -27.48 66.21 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.186 0.595 . . . . 0.0 111.277 172.618 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -71.08 -40.42 61.98 Favored Glycine 0 N--CA 1.473 1.113 0 CA-C-O 124.781 2.323 . . . . 0.0 110.752 167.378 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.551 ' CE1' HD13 ' A' ' 35' ' ' LEU . 2.0 t80 -77.54 -35.88 52.87 Favored 'General case' 0 N--CA 1.41 -2.468 0 CA-C-N 111.22 -2.49 . . . . 0.0 116.677 -163.214 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -65.61 -28.09 68.88 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 118.258 -0.877 . . . . 0.0 110.909 169.363 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.408 ' HA ' ' HE2' ' A' ' 55' ' ' LYS . 0.1 OUTLIER -66.51 -42.5 87.21 Favored 'General case' 0 C--N 1.346 0.433 0 CA-C-N 119.731 1.151 . . . . 0.0 109.367 168.981 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -58.09 -46.94 84.66 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.51 0.724 . . . . 0.0 110.765 174.055 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 48.3 tt0 -64.24 -45.63 87.33 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 125.903 1.681 . . . . 0.0 109.93 -176.648 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -60.15 -42.26 94.53 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.803 0.841 . . . . 0.0 110.634 174.513 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 37.4 tp10 -60.68 -41.67 95.59 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.277 0.489 . . . . 0.0 111.254 170.842 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -66.16 -29.78 70.14 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-O 117.832 -1.08 . . . . 0.0 111.821 -178.082 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 95.0 mt -53.15 -40.48 64.33 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 119.485 1.039 . . . . 0.0 110.738 171.167 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 17.8 p -66.1 -49.62 66.91 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.451 0.7 . . . . 0.0 110.325 178.421 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 14.5 ttp180 -53.61 -48.03 69.66 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.889 0.876 . . . . 0.0 110.39 175.252 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -76.07 -0.12 20.73 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 125.438 1.495 . . . . 0.0 114.923 -178.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 34.1 m -104.41 -8.38 19.21 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 127.467 2.307 . . . . 0.0 114.179 171.146 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . 50.47 39.86 21.83 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 129.518 3.127 . . . . 0.0 111.889 -173.664 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 34.8 m -160.97 147.98 15.24 Favored 'General case' 0 C--O 1.232 0.137 0 C-N-CA 124.352 1.061 . . . . 0.0 108.604 171.137 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 73.5 mttt . . . . . 0 N--CA 1.453 -0.288 0 C-N-CA 125.151 1.381 . . . . 0.0 109.219 -171.466 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.5 tpt . . . . . 0 CA--C 1.539 0.541 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -74.13 67.95 5.04 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 124.022 3.148 . . . . 0.0 110.31 175.82 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -63.21 135.75 57.3 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.862 0.865 . . . . 0.0 110.264 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 56.2 mtmt -68.67 -10.62 57.31 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 170.383 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -145.01 95.65 5.13 Favored Pre-proline 0 C--N 1.321 -0.656 0 C-N-CA 128.259 2.624 . . . . 0.0 108.358 173.117 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_exo -54.97 -30.59 70.1 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 125.175 3.916 . . . . 0.0 113.639 -172.391 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 91.6 m -97.74 -11.87 22.93 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 125.83 1.652 . . . . 0.0 113.261 -169.026 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 23.1 tp60 -62.52 -26.83 68.76 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 118.194 0.452 . . . . 0.0 110.722 -178.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 51.5 tttm -58.4 -56.09 26.65 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 123.605 0.762 . . . . 0.0 110.497 169.641 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -62.73 -44.53 95.97 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.3 0.64 . . . . 0.0 109.667 -176.641 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -52.98 -38.76 62.49 Favored 'General case' 0 N--CA 1.462 0.171 0 C-N-CA 125.056 1.343 . . . . 0.0 113.218 173.012 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 66.4 m -60.03 -44.09 94.86 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 120.162 -0.615 . . . . 0.0 110.333 172.252 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -66.75 -27.59 67.73 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 117.324 -1.322 . . . . 0.0 113.196 -179.276 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.8 mp -55.88 -48.82 77.87 Favored 'Isoleucine or valine' 0 C--N 1.343 0.294 0 CA-C-N 121.037 1.744 . . . . 0.0 109.598 169.668 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -59.91 -55.98 27.41 Favored 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 24.3 mmtm -68.86 -31.56 70.61 Favored 'General case' 0 CA--C 1.522 -0.098 0 CA-C-O 118.527 -0.749 . . . . 0.0 112.004 -171.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 27.6 t -55.04 -47.01 75.34 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 169.819 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.54 -45.44 91.78 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-O 118.435 -0.793 . . . . 0.0 110.463 179.248 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -57.97 -46.56 84.95 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 119.261 0.937 . . . . 0.0 111.007 174.24 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.62 -14.86 59.86 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.044 0.937 . . . . 0.0 113.365 176.335 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 -120.8 8.34 10.55 Favored 'General case' 0 C--N 1.343 0.298 0 C-N-CA 124.334 1.054 . . . . 0.0 112.056 -174.509 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.5 m 57.56 40.75 26.64 Favored 'General case' 0 C--N 1.345 0.406 0 CA-C-O 122.511 1.148 . . . . 0.0 110.78 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.269 6.9 m-85 72.59 14.39 5.17 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 128.045 2.538 . . . . 0.0 114.48 168.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 69.5 mtm -70.08 82.39 0.5 Allowed 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 125.13 1.372 . . . . 0.0 109.941 169.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -52.97 -24.44 9.4 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.637 1.175 . . . . 0.0 111.164 169.54 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.0 m -51.4 -44.12 62.12 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 126.107 1.763 . . . . 0.0 112.201 169.786 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.3 mmtt -73.11 -47.77 41.44 Favored 'General case' 0 C--O 1.232 0.182 0 C-N-CA 124.634 1.174 . . . . 0.0 108.963 176.867 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.0 m -69.51 0.61 5.01 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 124.648 1.179 . . . . 0.0 113.073 -176.772 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 52.4 mm-40 -54.9 -30.27 57.91 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 119.887 1.221 . . . . 0.0 110.8 166.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.01 -54.79 43.12 Favored 'General case' 0 C--N 1.344 0.367 0 C-N-CA 124.702 1.201 . . . . 0.0 111.463 173.024 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.0 p -75.56 -31.02 22.63 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.727 0 C-N-CA 122.871 0.468 . . . . 0.0 110.405 -174.403 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.56 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 69.1 mt -59.03 -46.32 91.79 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 N-CA-C 106.345 -1.724 . . . . 0.0 106.345 168.649 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.71 -26.48 61.82 Favored 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 121.011 -1.056 . . . . 0.0 113.281 173.706 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -76.49 -37.76 56.32 Favored 'General case' 0 N--CA 1.432 -1.356 0 C-N-CA 119.846 -0.742 . . . . 0.0 110.277 175.16 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.497 ' HB3' ' CE2' ' A' ' 53' ' ' PHE . 2.8 mt -62.6 -32.37 73.36 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-O 117.778 -1.106 . . . . 0.0 109.514 169.5 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.5 mmt180 -62.79 -53.8 48.75 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 120.163 1.347 . . . . 0.0 108.195 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 54.6 mttp -64.2 -34.44 78.1 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.177 -178.748 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 47.5 t -63.25 -51.57 65.63 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 110.105 -0.332 . . . . 0.0 110.105 169.615 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 45.5 t -65.05 -47.77 76.2 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 124.673 1.189 . . . . 0.0 111.84 -169.065 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.93 -1.02 6.35 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 115.551 -0.75 . . . . 0.0 112.331 -175.711 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.563 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 12.0 tt0 -80.28 -11.66 59.7 Favored 'General case' 0 N--CA 1.443 -0.821 0 C-N-CA 125.94 1.696 . . . . 0.0 110.999 176.643 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.563 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 84.9 m-85 -136.42 158.03 74.21 Favored Pre-proline 0 N--CA 1.439 -0.99 0 C-N-CA 125.449 1.499 . . . . 0.0 111.243 -167.814 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -68.25 109.0 1.89 Allowed 'Trans proline' 0 N--CA 1.455 -0.771 0 N-CA-C 104.295 -3.002 . . . . 0.0 104.295 165.124 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.51 -36.49 0.39 Allowed 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 117.739 2.496 . . . . 0.0 117.739 -165.668 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.2 -14.72 12.42 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 124.55 1.071 . . . . 0.0 114.234 174.531 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 35.6 tpt85 -51.99 -33.2 37.12 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 126.986 2.114 . . . . 0.0 111.542 168.768 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.2 t -136.92 139.53 41.63 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-O 122.428 1.109 . . . . 0.0 110.625 -168.449 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 15.3 t -68.15 -54.08 24.71 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.695 0 CA-C-N 114.016 -1.447 . . . . 0.0 108.362 177.862 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 6.8 m -62.48 -42.42 95.67 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.119 -176.267 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 36.7 t -64.06 -32.37 73.89 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.634 1.574 . . . . 0.0 110.284 177.758 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.0 m -69.57 -26.04 64.28 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.83 -0.544 . . . . 0.0 111.131 171.348 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.91 -32.05 66.64 Favored Glycine 0 C--N 1.344 0.985 0 CA-C-O 123.427 1.571 . . . . 0.0 111.266 167.067 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.56 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 1.2 t80 -80.57 -43.23 20.97 Favored 'General case' 0 N--CA 1.417 -2.097 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 -164.206 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 25.6 mm-40 -67.51 -24.25 65.55 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 119.634 -0.826 . . . . 0.0 110.4 171.17 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 58.4 mttp -69.73 -37.76 76.63 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 120.998 -1.064 . . . . 0.0 109.49 166.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -62.17 -33.72 75.05 Favored 'General case' 0 C--O 1.22 -0.469 0 O-C-N 121.659 -0.651 . . . . 0.0 111.403 170.581 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 40.6 tp10 -63.27 -45.52 91.1 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 120.054 1.297 . . . . 0.0 109.403 174.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.54 -41.31 85.24 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 119.219 -0.42 . . . . 0.0 110.524 173.264 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -58.87 -50.82 72.57 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 118.627 0.649 . . . . 0.0 110.74 173.117 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -59.54 -37.75 79.24 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 123.464 0.706 . . . . 0.0 110.198 -178.559 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 55.6 mt -64.01 -26.97 68.81 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 118.236 -0.888 . . . . 0.0 112.175 176.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 29.0 p -65.25 -49.05 71.11 Favored 'General case' 0 C--N 1.344 0.342 0 CA-C-N 119.912 1.233 . . . . 0.0 110.047 169.621 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 13.0 mtm180 -65.16 -32.78 74.64 Favored 'General case' 0 C--N 1.339 0.11 0 C-N-CA 123.499 0.719 . . . . 0.0 111.322 -178.831 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? 40.66 40.94 1.02 Allowed 'General case' 0 C--N 1.344 0.361 0 C-N-CA 127.77 2.428 . . . . 0.0 111.785 -169.51 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.3 m -175.76 176.43 1.86 Allowed 'General case' 0 C--O 1.239 0.506 0 C-N-CA 127.799 2.44 . . . . 0.0 108.292 -177.508 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -63.91 153.68 36.2 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.017 0.927 . . . . 0.0 110.467 169.68 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 35.9 p -64.31 108.47 1.61 Allowed 'General case' 0 C--O 1.239 0.505 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 169.093 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 60.6 mtpt . . . . . 0 N--CA 1.464 0.236 0 C-N-CA 123.542 0.737 . . . . 0.0 110.426 174.119 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 mmt . . . . . 0 CA--C 1.538 0.51 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -56.54 156.11 23.45 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.711 2.274 . . . . 0.0 112.749 177.236 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 8.8 mp0 -69.16 17.9 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 127.722 2.409 . . . . 0.0 114.399 -172.394 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 55.6 tptt -141.41 136.26 31.19 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 126.263 1.825 . . . . 0.0 107.82 176.255 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -94.27 104.26 13.22 Favored Pre-proline 0 N--CA 1.447 -0.588 0 N-CA-C 105.941 -1.874 . . . . 0.0 105.941 169.033 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -54.7 -34.75 85.13 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 124.497 3.465 . . . . 0.0 112.664 -170.578 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.401 ' HB3' ' CD2' ' A' ' 35' ' ' LEU . 77.5 m -94.48 -13.77 25.82 Favored 'General case' 0 N--CA 1.433 -1.319 0 C-N-CA 125.54 1.536 . . . . 0.0 113.03 -169.313 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 26.2 tp60 -61.85 -25.28 67.43 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 118.754 0.707 . . . . 0.0 111.224 -179.136 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 51.8 tttm -59.53 -56.62 19.71 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.766 1.226 . . . . 0.0 110.166 169.148 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -63.61 -38.23 90.34 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.73 0.812 . . . . 0.0 110.203 -177.461 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.99 -42.17 72.14 Favored 'General case' 0 C--N 1.339 0.148 0 C-N-CA 124.901 1.28 . . . . 0.0 112.816 171.18 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 82.0 m -57.56 -46.48 83.89 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.29 172.713 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -62.99 -25.44 68.38 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 117.84 -1.076 . . . . 0.0 112.253 -178.869 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.408 HD13 HG13 ' A' ' 31' ' ' VAL . 34.6 mm -57.15 -54.47 29.98 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.378 0 CA-C-N 120.019 1.281 . . . . 0.0 109.235 172.909 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 36.7 mm-40 -58.18 -54.47 46.65 Favored 'General case' 0 N--CA 1.443 -0.816 0 O-C-N 124.18 0.925 . . . . 0.0 108.934 -178.547 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -66.5 -32.68 74.18 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 118.925 -1.11 . . . . 0.0 111.693 -175.309 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 25.2 t -56.2 -48.89 75.53 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 119.443 1.02 . . . . 0.0 108.902 169.397 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.73 -46.8 86.55 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 123.244 0.618 . . . . 0.0 110.487 179.826 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -57.11 -45.92 83.04 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.977 0.911 . . . . 0.0 111.199 174.35 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.54 -12.4 52.5 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.18 0.992 . . . . 0.0 113.424 175.3 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 52.2 m-80 -124.67 8.83 8.27 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.688 1.195 . . . . 0.0 112.187 -173.13 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.1 m 57.93 40.31 25.85 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.646 1.112 . . . . 0.0 110.979 179.697 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.265 6.9 m-85 72.17 14.05 5.66 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 127.817 2.447 . . . . 0.0 114.619 168.846 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 64.5 mtm -69.47 86.52 0.44 Allowed 'General case' 0 N--CA 1.44 -0.964 0 C-N-CA 125.127 1.371 . . . . 0.0 109.962 169.9 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -53.5 -26.12 19.42 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.252 1.021 . . . . 0.0 111.21 169.501 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.5 m -57.05 -32.13 65.89 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 127.497 2.319 . . . . 0.0 113.514 170.541 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.5 mmtm -79.62 -45.55 18.89 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.251 1.02 . . . . 0.0 108.769 171.917 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 81.2 m -73.88 9.0 1.67 Allowed 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 125.675 1.59 . . . . 0.0 113.709 -175.117 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.597 HE22 ' NH2' ' A' ' 63' ' ' ARG . 59.9 mm-40 -53.16 -38.14 62.48 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.425 -0.797 . . . . 0.0 110.737 168.049 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.31 -50.11 74.94 Favored 'General case' 0 C--N 1.342 0.242 0 C-N-CA 123.666 0.786 . . . . 0.0 111.631 178.21 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.408 HG13 HD13 ' A' ' 14' ' ' ILE . 8.7 p -75.13 -28.4 20.68 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.841 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.741 -175.889 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.482 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 55.4 mt -61.19 -50.14 81.72 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.637 0 N-CA-C 106.852 -1.536 . . . . 0.0 106.852 169.003 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -55.23 -27.81 48.83 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 123.819 0.848 . . . . 0.0 111.139 176.257 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -74.66 -43.29 56.02 Favored 'General case' 0 N--CA 1.441 -0.91 0 O-C-N 121.75 -0.594 . . . . 0.0 112.421 174.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.435 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 2.6 mt -62.14 -30.38 71.0 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 119.393 0.997 . . . . 0.0 110.547 170.417 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.9 ttt-85 -64.78 -58.88 5.04 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 126.433 1.893 . . . . 0.0 110.155 178.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.7 ptmt -65.94 -27.98 68.57 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.796 -179.489 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 47.7 t -65.76 -51.44 59.16 Favored 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 168.422 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.1 t -62.9 -48.78 77.49 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.435 0.694 . . . . 0.0 112.186 -169.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.48 -2.81 5.07 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 124.176 0.99 . . . . 0.0 112.608 -176.39 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.559 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 14.2 tt0 -79.26 -12.15 59.95 Favored 'General case' 0 N--CA 1.441 -0.883 0 C-N-CA 125.57 1.548 . . . . 0.0 111.032 175.677 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.559 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 83.9 m-85 -135.31 159.22 72.6 Favored Pre-proline 0 N--CA 1.442 -0.833 0 C-N-CA 125.032 1.333 . . . . 0.0 111.801 -167.949 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -69.19 115.14 3.87 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 N-CA-C 104.926 -2.759 . . . . 0.0 104.926 165.157 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.485 ' H ' ' HE2' ' A' ' 44' ' ' LYS . 0.3 OUTLIER -38.6 -44.39 0.97 Allowed 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 116.234 1.939 . . . . 0.0 116.234 -166.417 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -56.89 -12.36 6.87 Favored Glycine 0 CA--C 1.535 1.327 0 C-N-CA 124.842 1.21 . . . . 0.0 114.328 178.105 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 34.8 tpt85 -54.28 -34.24 60.4 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 127.01 2.124 . . . . 0.0 111.91 169.337 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.5 t -143.23 142.13 31.3 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 122.344 1.068 . . . . 0.0 111.055 -168.564 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 6.5 t -70.03 -56.39 11.45 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 CA-C-N 114.257 -1.338 . . . . 0.0 108.84 -179.01 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.2 m -60.23 -37.56 74.06 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 122.927 0.491 . . . . 0.0 110.581 -177.037 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' CYS . . . . . 0.452 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 8.1 t -69.37 -38.29 77.97 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.278 1.031 . . . . 0.0 109.919 177.663 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 44.5 m -65.04 -27.07 68.55 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.605 -0.685 . . . . 0.0 110.506 171.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.61 -25.61 75.42 Favored Glycine 0 C--N 1.343 0.959 0 CA-C-O 121.455 0.475 . . . . 0.0 112.5 169.66 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.482 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 0.3 OUTLIER -80.69 -46.42 15.58 Favored 'General case' 0 N--CA 1.431 -1.412 0 N-CA-C 115.449 1.648 . . . . 0.0 115.449 -165.489 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -64.19 -17.94 64.01 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.925 173.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 10.5 mmpt? -81.71 -44.09 17.56 Favored 'General case' 0 C--N 1.348 0.52 0 C-N-CA 123.952 0.901 . . . . 0.0 110.595 165.647 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -56.76 -26.77 58.2 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.399 1.079 . . . . 0.0 111.549 173.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.7 -40.34 75.44 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.678 1.191 . . . . 0.0 109.657 173.497 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -66.41 -40.11 89.37 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.818 0.847 . . . . 0.0 109.883 176.524 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -53.9 -51.28 64.24 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 122.855 0.462 . . . . 0.0 110.659 169.727 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -63.13 -37.42 87.14 Favored 'General case' 0 C--N 1.327 -0.379 0 O-C-N 121.823 -0.548 . . . . 0.0 111.093 -175.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.9 tp -67.99 -43.67 78.39 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 126.331 1.852 . . . . 0.0 109.046 179.441 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -68.64 -31.26 70.28 Favored 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.902 -0.499 . . . . 0.0 110.963 176.236 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.597 ' NH2' HE22 ' A' ' 29' ' ' GLN . 15.4 ttm105 -76.02 -39.66 55.21 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 -176.107 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -66.55 178.74 1.18 Allowed 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 122.091 0.948 . . . . 0.0 113.331 -171.035 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 7.9 m -56.96 162.02 2.67 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.953 1.301 . . . . 0.0 111.437 174.161 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . 58.7 25.53 13.48 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.987 1.315 . . . . 0.0 112.902 -169.341 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 45.0 t -147.82 -179.65 7.05 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 128.424 2.689 . . . . 0.0 106.418 169.437 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 98.9 mttt . . . . . 0 N--CA 1.468 0.434 0 C-N-CA 127.383 2.273 . . . . 0.0 111.92 -178.965 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.9 mmt . . . . . 0 CA--C 1.538 0.49 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -71.35 135.14 26.1 Favored 'Trans proline' 0 N--CA 1.455 -0.769 0 C-N-CA 122.628 2.218 . . . . 0.0 110.185 170.833 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 11.4 mp0 -65.97 -26.77 67.71 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 126.6 1.96 . . . . 0.0 113.166 -168.262 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.7 ttpt -62.47 109.92 1.52 Allowed 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 107.663 -1.236 . . . . 0.0 107.663 171.353 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 18.1 t0 -93.96 103.29 9.99 Favored Pre-proline 0 N--CA 1.448 -0.551 0 C-N-CA 125.526 1.53 . . . . 0.0 108.185 -171.228 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -56.84 -34.48 96.86 Favored 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 123.979 3.119 . . . . 0.0 112.699 -170.253 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 69.2 m -94.24 -13.06 26.97 Favored 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 125.134 1.374 . . . . 0.0 112.914 -169.745 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 33.3 tp60 -62.72 -25.81 68.36 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 118.614 0.643 . . . . 0.0 110.827 179.206 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 50.7 tptt -60.11 -54.49 45.3 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 123.336 0.654 . . . . 0.0 110.21 169.238 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -62.98 -38.99 93.38 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.382 0.673 . . . . 0.0 109.907 -177.762 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -55.35 -45.02 76.48 Favored 'General case' 0 CA--C 1.518 -0.288 0 C-N-CA 124.954 1.302 . . . . 0.0 112.406 169.585 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 62.6 m -59.09 -40.34 85.0 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 118.119 0.418 . . . . 0.0 111.337 173.208 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -65.4 -21.52 66.68 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-O 117.776 -1.107 . . . . 0.0 112.679 176.902 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.431 HD13 HG13 ' A' ' 31' ' ' VAL . 28.0 mm -60.26 -50.37 80.51 Favored 'Isoleucine or valine' 0 C--N 1.342 0.28 0 CA-C-N 120.532 1.514 . . . . 0.0 109.388 171.923 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -58.75 -57.08 14.58 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 107.409 -1.33 . . . . 0.0 107.409 179.618 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 42.0 mtpt -68.35 -29.43 68.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 118.597 -0.716 . . . . 0.0 111.701 -169.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.402 ' CB ' HG11 ' A' ' 31' ' ' VAL . 25.7 t -56.15 -47.56 77.96 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 118.889 0.768 . . . . 0.0 109.186 169.024 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.41 -44.86 89.22 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 118.662 -0.685 . . . . 0.0 111.086 178.748 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.471 ' HA ' ' CE1' ' A' ' 23' ' ' TYR . 3.0 mp0 -58.37 -43.49 88.48 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 118.214 0.461 . . . . 0.0 111.428 173.665 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.99 -12.44 61.61 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 114.189 1.181 . . . . 0.0 114.189 176.23 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -125.87 15.01 8.02 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 119.673 1.124 . . . . 0.0 113.789 -168.817 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 18.1 m 60.56 35.1 20.16 Favored 'General case' 0 C--N 1.346 0.414 0 CA-C-N 120.619 1.554 . . . . 0.0 110.067 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.471 ' CE1' ' HA ' ' A' ' 19' ' ' GLN . 38.0 m-85 68.18 14.83 9.33 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 126.588 1.955 . . . . 0.0 113.737 167.931 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 62.9 mtm -74.54 89.72 2.2 Favored 'General case' 0 N--CA 1.439 -1.021 0 C-N-CA 126.048 1.739 . . . . 0.0 108.903 175.553 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -55.42 -23.77 26.74 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 119.165 -0.445 . . . . 0.0 111.405 172.762 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.4 m -52.33 -44.69 65.3 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 126.424 1.89 . . . . 0.0 112.098 170.22 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 62.8 mmtt -67.32 -47.65 69.9 Favored 'General case' 0 C--N 1.341 0.205 0 C-N-CA 123.832 0.853 . . . . 0.0 108.959 174.044 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.425 ' O ' HG12 ' A' ' 31' ' ' VAL . 71.8 m -71.31 0.61 7.66 Favored 'General case' 0 N--CA 1.443 -0.791 0 C-N-CA 124.455 1.102 . . . . 0.0 112.945 -174.181 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 -56.59 -25.71 53.48 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 120.042 1.292 . . . . 0.0 111.101 167.186 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.06 -49.43 76.94 Favored 'General case' 0 C--N 1.345 0.381 0 C-N-CA 125.648 1.579 . . . . 0.0 112.174 169.473 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.431 HG13 HD13 ' A' ' 14' ' ' ILE . 7.4 p -82.67 -26.5 8.45 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.877 0 C-N-CA 123.917 0.887 . . . . 0.0 109.88 -174.952 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.5 mp -59.39 -47.06 91.95 Favored 'Isoleucine or valine' 0 C--N 1.348 0.541 0 N-CA-C 105.476 -2.046 . . . . 0.0 105.476 165.418 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.14 -32.53 62.16 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 123.12 0.568 . . . . 0.0 112.002 175.372 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -74.92 -39.88 61.17 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 119.951 -0.7 . . . . 0.0 111.463 178.361 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.496 HD13 ' CE1' ' A' ' 53' ' ' PHE . 1.6 mt -63.6 -35.48 80.65 Favored 'General case' 0 C--N 1.342 0.248 0 CA-C-N 119.217 0.917 . . . . 0.0 110.097 173.57 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.07 -60.46 3.46 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 125.104 1.361 . . . . 0.0 109.592 174.357 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -59.95 -38.54 82.77 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 113.728 -1.578 . . . . 0.0 110.235 -176.632 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 52.3 t -60.44 -52.06 66.84 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 122.937 0.495 . . . . 0.0 109.678 171.253 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 38.1 t -60.15 -43.36 95.82 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 121.09 0.472 . . . . 0.0 111.323 -172.819 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.04 -2.03 6.95 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 125.383 1.473 . . . . 0.0 113.378 179.476 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.556 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 23.3 tt0 -80.46 -8.81 59.69 Favored 'General case' 0 N--CA 1.442 -0.84 0 C-N-CA 123.882 0.873 . . . . 0.0 110.523 171.809 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.556 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 84.6 m-85 -141.07 167.12 18.37 Favored Pre-proline 0 N--CA 1.444 -0.765 0 C-N-CA 125.659 1.584 . . . . 0.0 111.458 -167.847 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -66.24 139.42 55.03 Favored 'Trans proline' 0 CA--C 1.538 0.698 0 N-CA-C 106.633 -2.103 . . . . 0.0 106.633 164.916 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.9 ptpp? -57.92 -26.69 62.55 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 115.115 1.524 . . . . 0.0 115.115 -168.857 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -80.69 0.62 85.66 Favored Glycine 0 CA--C 1.531 1.07 0 C-N-CA 124.24 0.924 . . . . 0.0 113.817 177.338 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 46.0 tpt85 -58.13 -35.97 72.27 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-N 119.368 1.584 . . . . 0.0 112.623 179.217 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -141.14 151.36 43.83 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 124.832 1.253 . . . . 0.0 110.038 -166.258 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 8.8 t -69.02 -56.68 11.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 123.938 0.895 . . . . 0.0 109.259 -177.37 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 9.2 m -59.73 -38.96 78.34 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 C-N-CA 122.954 0.502 . . . . 0.0 109.982 -179.09 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' CYS . . . . . 0.477 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 11.2 t -68.39 -35.37 77.59 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.349 1.06 . . . . 0.0 109.837 179.374 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 48.9 m -64.36 -28.15 69.5 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 121.744 -0.598 . . . . 0.0 110.592 172.491 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -74.38 -25.14 71.28 Favored Glycine 0 C--N 1.344 1.012 0 CA-C-O 121.981 0.767 . . . . 0.0 111.809 172.005 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.496 ' CE1' HD13 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -81.9 -50.25 9.39 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.944 1.698 . . . . 0.0 114.447 -167.805 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -64.84 -22.23 66.95 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 115.591 -0.732 . . . . 0.0 110.434 174.18 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 63.6 tttm -70.68 -40.75 72.75 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 118.971 0.805 . . . . 0.0 110.445 167.086 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -56.09 -51.56 67.45 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 118.924 0.784 . . . . 0.0 109.719 170.481 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -63.76 -39.28 93.89 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.631 1.172 . . . . 0.0 110.95 -177.756 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -59.34 -47.05 86.86 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.74 0.816 . . . . 0.0 110.194 171.245 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -55.5 -47.13 76.68 Favored 'General case' 0 C--O 1.223 -0.294 0 CA-C-N 117.936 0.335 . . . . 0.0 110.349 173.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -62.51 -53.08 60.09 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 118.086 0.403 . . . . 0.0 110.754 -177.597 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.6 pp -67.19 -36.01 80.85 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 118.906 -0.569 . . . . 0.0 110.891 -173.613 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.11 -32.82 65.2 Favored 'General case' 0 C--N 1.341 0.239 0 CA-C-N 118.577 0.626 . . . . 0.0 111.299 176.318 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 25.0 ttm180 -75.9 -18.29 59.45 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 122.749 0.419 . . . . 0.0 111.814 174.573 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 21.3 tptp 57.35 37.19 27.93 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 128.03 2.532 . . . . 0.0 110.419 -175.03 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 23.0 t -157.24 -178.94 7.73 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 125.077 1.351 . . . . 0.0 109.034 -178.375 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -102.86 15.52 29.13 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.248 1.819 . . . . 0.0 111.727 168.924 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 29.3 m -70.56 39.23 0.05 Allowed 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 129.058 2.943 . . . . 0.0 112.359 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 12.2 ptpt . . . . . 0 CA--C 1.529 0.153 0 C-N-CA 126.41 1.884 . . . . 0.0 111.754 -178.659 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.4 ptm . . . . . 0 N--CA 1.443 -0.785 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -68.67 160.63 48.66 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 122.015 1.81 . . . . 0.0 110.095 169.599 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 20.8 mp0 -74.43 58.38 0.75 Allowed 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.465 1.906 . . . . 0.0 111.443 -175.723 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.41 ' HG3' ' H ' ' A' ' 5' ' ' ASP . 22.5 tptp 58.05 -177.08 0.07 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 126.821 2.048 . . . . 0.0 111.346 -173.811 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.41 ' H ' ' HG3' ' A' ' 4' ' ' LYS . 12.6 t0 -145.26 112.38 4.74 Favored Pre-proline 0 N--CA 1.448 -0.572 0 C-N-CA 129.678 3.191 . . . . 0.0 102.92 177.807 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -66.79 -35.88 26.03 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 123.555 2.837 . . . . 0.0 112.219 -169.494 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 87.5 m -94.77 -13.65 25.45 Favored 'General case' 0 N--CA 1.436 -1.155 0 C-N-CA 124.006 0.922 . . . . 0.0 113.45 -167.349 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.472 ' HA ' HG11 ' A' ' 49' ' ' VAL . 1.9 tm0? -51.21 -37.49 47.05 Favored 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 125.289 1.436 . . . . 0.0 111.489 171.899 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -57.23 -58.76 6.8 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 125.323 1.449 . . . . 0.0 110.039 171.913 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -62.39 -36.93 83.85 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.271 0.628 . . . . 0.0 110.774 -176.329 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -57.95 -38.91 76.84 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.617 1.167 . . . . 0.0 112.172 172.658 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 75.5 m -61.36 -43.06 99.51 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 118.399 0.545 . . . . 0.0 110.718 172.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -63.79 -22.33 66.86 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 117.95 -1.024 . . . . 0.0 112.328 178.835 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 23.9 mm -60.51 -53.7 45.28 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.334 0 CA-C-N 120.291 1.405 . . . . 0.0 109.277 171.571 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 16.8 mm-40 -61.35 -52.34 65.05 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 -178.239 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 40.7 mtpt -68.13 -30.75 69.97 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 118.29 -0.862 . . . . 0.0 111.354 -174.536 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 14.1 t -58.01 -47.94 81.53 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-N 119.298 0.954 . . . . 0.0 108.444 168.36 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.7 -47.02 83.55 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.287 0.635 . . . . 0.0 110.384 179.068 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -57.46 -44.9 85.19 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.918 0.887 . . . . 0.0 111.193 174.119 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.58 -12.76 59.37 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 175.016 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 47.9 m-80 -124.37 8.63 8.44 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 124.584 1.154 . . . . 0.0 112.308 -172.46 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 58.61 40.11 23.92 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 122.367 1.08 . . . . 0.0 110.915 179.658 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.258 7.1 m-85 71.98 13.98 5.87 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 127.883 2.473 . . . . 0.0 114.619 168.78 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 68.3 mtm -70.63 83.93 0.62 Allowed 'General case' 0 N--CA 1.443 -0.821 0 C-N-CA 125.128 1.371 . . . . 0.0 109.695 170.437 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -54.4 -23.26 15.03 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.687 0.795 . . . . 0.0 111.722 172.283 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.6 m -53.03 -40.87 64.21 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 126.013 1.725 . . . . 0.0 112.273 170.047 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 50.6 mmtt -70.81 -47.69 58.13 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 124.31 1.044 . . . . 0.0 108.809 174.51 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.6 m -73.12 1.37 9.25 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 124.711 1.205 . . . . 0.0 113.267 -173.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 76.0 mm-40 -54.41 -31.08 54.31 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 119.485 1.039 . . . . 0.0 110.488 167.242 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.69 -58.23 8.69 Favored 'General case' 0 C--N 1.345 0.39 0 C-N-CA 124.884 1.274 . . . . 0.0 111.463 174.096 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.8 p -74.6 -28.99 22.77 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.91 0 C-N-CA 123.981 0.913 . . . . 0.0 109.995 -173.243 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.469 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 58.1 mt -59.52 -48.99 85.29 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 N-CA-C 105.943 -1.873 . . . . 0.0 105.943 168.043 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.5 ' HA ' ' HG3' ' A' ' 36' ' ' ARG . 0.7 OUTLIER -61.1 -31.6 71.28 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 119.325 0.966 . . . . 0.0 113.097 175.572 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -68.49 -39.92 81.14 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 119.433 1.015 . . . . 0.0 110.089 175.35 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.52 HD13 ' CE1' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -63.33 -29.05 70.43 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 124.648 1.179 . . . . 0.0 108.774 176.037 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.5 ' HG3' ' HA ' ' A' ' 33' ' ' GLN . 10.3 mmt85 -69.68 -50.44 43.85 Favored 'General case' 0 CA--C 1.512 -0.505 0 CA-C-N 119.203 0.91 . . . . 0.0 108.556 -179.881 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 62.9 mmtt -63.07 -32.84 74.3 Favored 'General case' 0 C--O 1.235 0.296 0 O-C-N 123.849 0.718 . . . . 0.0 111.069 178.735 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.2 t -62.5 -54.59 37.71 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 169.132 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 46.5 t -62.88 -47.95 81.11 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 124.058 0.943 . . . . 0.0 111.936 -169.694 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.26 -0.95 5.28 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 124.59 1.156 . . . . 0.0 112.609 -177.467 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.51 ' HB3' ' CE2' ' A' ' 42' ' ' TYR . 2.1 tp-100 -79.13 -11.69 59.98 Favored 'General case' 0 N--CA 1.438 -1.073 0 C-N-CA 123.767 0.827 . . . . 0.0 111.463 172.106 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.51 ' CE2' ' HB3' ' A' ' 41' ' ' GLN . 68.0 m-85 -137.27 156.66 75.21 Favored Pre-proline 0 N--CA 1.443 -0.812 0 C-N-CA 123.972 0.909 . . . . 0.0 112.151 -167.146 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.8 121.5 8.56 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 N-CA-C 105.645 -2.483 . . . . 0.0 105.645 166.501 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -44.5 -40.52 5.67 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 116.306 1.965 . . . . 0.0 116.306 -166.89 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.44 -13.78 31.61 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 123.783 0.706 . . . . 0.0 113.657 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.06 -21.19 66.0 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.859 1.263 . . . . 0.0 112.449 171.093 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.8 t -142.84 137.03 29.33 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-O 122.988 1.375 . . . . 0.0 111.107 -176.44 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 19.3 t -66.98 -53.45 33.93 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.615 0 CA-C-N 113.852 -1.522 . . . . 0.0 108.926 -178.835 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.472 HG11 ' HA ' ' A' ' 8' ' ' GLN . 2.4 m -59.81 -46.65 93.45 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 -178.761 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 42.2 t -63.0 -30.65 71.77 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.952 1.301 . . . . 0.0 109.924 -176.678 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 64.5 m -68.0 -24.81 65.17 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 118.663 -0.684 . . . . 0.0 111.893 174.073 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -74.08 -40.22 43.31 Favored Glycine 0 N--CA 1.471 1.001 0 CA-C-O 124.288 2.049 . . . . 0.0 111.193 167.118 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.52 ' CE1' HD13 ' A' ' 35' ' ' LEU . 2.0 t80 -76.63 -37.67 55.97 Favored 'General case' 0 N--CA 1.411 -2.395 0 CA-C-N 111.055 -2.573 . . . . 0.0 116.848 -162.545 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -63.39 -26.08 68.58 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 119.651 -0.82 . . . . 0.0 110.766 169.846 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.2 mtmp? -70.49 -41.16 73.04 Favored 'General case' 0 C--N 1.348 0.523 0 CA-C-N 119.657 1.117 . . . . 0.0 110.403 170.35 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -56.18 -48.91 75.43 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.23 1.012 . . . . 0.0 109.816 173.127 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -62.53 -46.72 87.09 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 125.646 1.578 . . . . 0.0 110.488 -179.274 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -59.17 -41.74 89.13 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 122.67 0.388 . . . . 0.0 110.755 173.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -60.49 -43.52 96.93 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 118.368 0.531 . . . . 0.0 110.942 173.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -64.79 -33.48 76.09 Favored 'General case' 0 C--N 1.329 -0.285 0 O-C-N 121.07 -1.019 . . . . 0.0 111.2 179.4 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 47.6 mt -72.64 -40.17 66.6 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 123.961 0.904 . . . . 0.0 109.527 178.565 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -63.62 -38.68 92.05 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 118.818 -0.61 . . . . 0.0 110.735 172.43 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 76.7 mmt-85 -62.04 -50.54 71.59 Favored 'General case' 0 C--N 1.347 0.489 0 CA-C-N 119.338 0.972 . . . . 0.0 110.291 172.502 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.435 ' HA ' ' HE3' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -75.95 59.83 1.31 Allowed 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.773 1.229 . . . . 0.0 110.511 177.863 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 59.8 p -137.29 177.12 8.11 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.519 1.528 . . . . 0.0 110.037 177.299 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -141.71 22.54 2.13 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.592 1.157 . . . . 0.0 111.76 171.113 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 28.6 m -175.55 169.09 3.15 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 128.232 2.613 . . . . 0.0 107.758 178.664 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp . . . . . 0 CA--C 1.529 0.164 0 C-N-CA 123.302 0.641 . . . . 0.0 109.555 174.704 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.1 mtt . . . . . 0 CA--C 1.544 0.738 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -55.48 112.43 1.05 Allowed 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 123.394 2.73 . . . . 0.0 111.35 -177.202 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 16.8 mp0 -55.33 -30.64 60.65 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.657 1.183 . . . . 0.0 113.395 -168.008 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.6 mmmt -104.2 0.87 29.96 Favored 'General case' 0 CA--C 1.515 -0.366 0 N-CA-C 115.424 1.638 . . . . 0.0 115.424 178.891 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -145.55 82.9 9.27 Favored Pre-proline 0 C--N 1.323 -0.564 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 168.574 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -51.62 -36.37 60.49 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 124.48 3.453 . . . . 0.0 112.37 -169.702 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 95.4 m -92.97 -8.73 42.25 Favored 'General case' 0 N--CA 1.436 -1.156 0 C-N-CA 126.538 1.935 . . . . 0.0 113.279 -169.152 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 29.4 tp60 -62.89 -24.97 68.08 Favored 'General case' 0 N--CA 1.446 -0.655 0 O-C-N 121.596 -0.69 . . . . 0.0 110.659 178.865 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -57.63 -56.78 17.52 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 123.424 0.689 . . . . 0.0 109.594 168.703 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 20.2 mp0 -59.06 -43.39 91.71 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 123.646 0.778 . . . . 0.0 110.203 -177.654 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.23 -44.11 71.44 Favored 'General case' 0 C--N 1.339 0.133 0 C-N-CA 124.404 1.081 . . . . 0.0 112.209 174.052 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 97.4 m -60.55 -45.64 93.14 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 117.498 0.135 . . . . 0.0 110.915 172.101 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 61.0 mm-40 -63.16 -23.65 67.53 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 117.577 -1.202 . . . . 0.0 112.745 178.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 43.7 mm -57.05 -54.16 33.76 Favored 'Isoleucine or valine' 0 C--N 1.342 0.254 0 CA-C-N 120.659 1.572 . . . . 0.0 109.233 172.229 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 34.7 mm-40 -58.75 -54.01 51.88 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 124.02 0.825 . . . . 0.0 109.086 -179.205 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.2 mptp? -66.81 -32.21 73.35 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 118.944 -1.102 . . . . 0.0 111.709 -174.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 24.7 t -56.42 -48.35 77.15 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 119.381 0.991 . . . . 0.0 108.841 169.029 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.32 -46.8 85.49 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 123.216 0.606 . . . . 0.0 110.628 179.297 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -56.97 -45.58 82.78 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.739 0.816 . . . . 0.0 111.205 174.021 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.95 -12.57 55.83 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.027 0.931 . . . . 0.0 113.437 175.262 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.7 m-80 -124.31 8.68 8.48 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.617 1.167 . . . . 0.0 112.228 -173.164 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 58.32 40.19 24.75 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 122.426 1.108 . . . . 0.0 110.913 179.619 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.255 6.9 m-85 71.98 13.64 5.92 Favored 'General case' 0 N--CA 1.445 -0.701 0 C-N-CA 127.817 2.447 . . . . 0.0 114.619 168.865 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 67.2 mtm -71.01 83.72 0.69 Allowed 'General case' 0 N--CA 1.44 -0.942 0 C-N-CA 125.144 1.378 . . . . 0.0 109.474 170.566 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -55.89 -22.11 23.9 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.949 0.9 . . . . 0.0 111.973 173.602 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 7.0 m -56.99 -34.18 67.87 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 126.728 2.011 . . . . 0.0 113.086 169.321 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 52.4 mmtt -74.89 -46.2 37.66 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 124.052 0.941 . . . . 0.0 108.74 171.813 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.3 m -73.73 6.13 3.45 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 125.133 1.373 . . . . 0.0 113.191 -174.792 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.584 HE22 ' NH2' ' A' ' 63' ' ' ARG . 40.0 mm-40 -54.93 -31.87 60.72 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 119.182 0.901 . . . . 0.0 110.139 167.138 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.33 -56.86 16.41 Favored 'General case' 0 C--N 1.345 0.391 0 C-N-CA 125.117 1.367 . . . . 0.0 111.433 174.116 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.7 p -73.69 -27.71 23.45 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 C-N-CA 123.843 0.857 . . . . 0.0 110.083 -174.308 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.546 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 63.6 mt -61.03 -49.53 84.34 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 N-CA-C 106.605 -1.628 . . . . 0.0 106.605 168.135 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -55.98 -30.84 62.37 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 118.915 0.78 . . . . 0.0 111.849 174.318 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -69.14 -46.19 68.24 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 118.862 0.756 . . . . 0.0 111.632 173.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.494 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.5 mt -55.74 -34.03 64.81 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-N 119.005 0.821 . . . . 0.0 109.577 172.384 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -70.39 -54.72 11.3 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 125.086 1.355 . . . . 0.0 111.648 -176.931 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 62.3 mttm -61.45 -34.7 75.88 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 124.728 1.211 . . . . 0.0 110.779 176.425 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 50.8 t -63.82 -51.01 66.65 Favored 'General case' 0 N--CA 1.444 -0.77 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 169.458 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 53.9 t -61.77 -50.07 73.82 Favored 'General case' 0 CA--C 1.515 -0.379 0 C-N-CA 123.446 0.698 . . . . 0.0 112.084 -172.029 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.51 -1.8 5.53 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 124.629 1.172 . . . . 0.0 111.98 -176.139 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.48 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 2.3 tp-100 -79.64 -8.12 58.99 Favored 'General case' 0 N--CA 1.438 -1.042 0 C-N-CA 124.589 1.156 . . . . 0.0 111.123 174.2 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.48 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 79.2 m-85 -141.6 163.1 43.23 Favored Pre-proline 0 N--CA 1.441 -0.913 0 C-N-CA 125.446 1.498 . . . . 0.0 111.024 -168.264 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -67.81 135.46 35.54 Favored 'Trans proline' 0 CA--C 1.537 0.638 0 N-CA-C 106.35 -2.212 . . . . 0.0 106.35 165.658 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -55.1 -29.47 57.7 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 114.889 1.44 . . . . 0.0 114.889 -168.55 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -67.86 -9.17 55.78 Favored Glycine 0 CA--C 1.533 1.201 0 CA-C-O 119.062 -0.855 . . . . 0.0 113.922 177.278 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 41.4 tpt85 -60.89 -31.97 71.44 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 119.171 1.486 . . . . 0.0 112.221 175.207 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.4 t -144.79 138.19 26.94 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 123.538 0.735 . . . . 0.0 110.273 -168.116 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 11.0 t -63.59 -56.75 15.15 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 CA-C-N 114.748 -1.115 . . . . 0.0 108.743 -178.365 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.2 m -59.01 -40.7 81.28 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 123.571 0.748 . . . . 0.0 110.438 -176.281 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' CYS . . . . . 0.412 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 6.9 t -66.64 -37.84 85.67 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.82 1.248 . . . . 0.0 109.648 179.016 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 27.1 p -65.56 -25.07 67.26 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 121.788 -0.57 . . . . 0.0 111.051 174.207 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.89 -26.77 68.26 Favored Glycine 0 C--N 1.346 1.095 0 CA-C-O 121.759 0.644 . . . . 0.0 112.423 170.049 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.546 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 0.4 OUTLIER -80.43 -46.51 15.84 Favored 'General case' 0 N--CA 1.429 -1.523 0 N-CA-C 116.043 1.868 . . . . 0.0 116.043 -164.641 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 71.2 mt-10 -61.86 -21.72 64.91 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.54 172.291 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -81.01 -44.33 18.25 Favored 'General case' 0 C--N 1.347 0.495 0 CA-C-N 119.242 0.928 . . . . 0.0 110.926 167.53 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -56.37 -26.29 52.44 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.025 0.93 . . . . 0.0 111.224 174.635 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -54.38 -44.69 72.48 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 124.557 1.143 . . . . 0.0 109.908 174.61 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -69.59 -32.6 71.44 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.927 0.891 . . . . 0.0 110.669 178.612 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -61.89 -45.14 95.06 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 117.816 0.28 . . . . 0.0 110.546 169.12 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -67.47 -27.47 67.05 Favored 'General case' 0 C--O 1.226 -0.143 0 C-N-CA 123.755 0.822 . . . . 0.0 111.757 -176.136 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 91.2 mt -52.44 -23.3 5.86 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 118.53 -0.747 . . . . 0.0 112.87 171.799 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 72.9 p -58.89 -64.67 0.85 Allowed 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 119.505 1.048 . . . . 0.0 109.638 169.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.584 ' NH2' HE22 ' A' ' 29' ' ' GLN . 61.2 mtm-85 -56.83 -45.15 82.53 Favored 'General case' 0 C--O 1.228 -0.027 0 C-N-CA 125.095 1.358 . . . . 0.0 111.095 177.975 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 23.2 mmtp -81.58 53.62 2.16 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.103 1.361 . . . . 0.0 110.064 -176.291 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 77.4 p -138.12 173.79 11.25 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 125.204 1.402 . . . . 0.0 111.828 178.139 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.35 132.8 55.06 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.422 1.089 . . . . 0.0 110.623 -176.391 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 95.5 p 60.19 17.04 6.55 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 125.713 1.605 . . . . 0.0 114.979 -174.589 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 29.3 mtpp . . . . . 0 N--CA 1.45 -0.444 0 C-N-CA 126.332 1.853 . . . . 0.0 108.041 173.32 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 90.3 mmm . . . . . 0 CA--C 1.537 0.465 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -62.96 123.77 12.82 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 122.683 2.255 . . . . 0.0 109.36 173.787 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 90.7 mm-40 -77.67 57.82 1.7 Allowed 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 125.559 1.543 . . . . 0.0 111.672 -170.5 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -63.19 146.52 53.18 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.986 0.914 . . . . 0.0 110.122 178.68 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -93.97 99.52 3.74 Favored Pre-proline 0 N--CA 1.446 -0.667 0 N-CA-C 106.288 -1.745 . . . . 0.0 106.288 169.158 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -60.18 -37.23 84.9 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 123.211 2.607 . . . . 0.0 111.964 -171.229 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 93.5 m -92.01 -9.51 42.61 Favored 'General case' 0 N--CA 1.443 -0.791 0 C-N-CA 125.189 1.396 . . . . 0.0 113.047 -167.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 20.1 tp60 -59.53 -25.51 64.57 Favored 'General case' 0 N--CA 1.439 -0.993 0 CA-C-O 118.99 -0.529 . . . . 0.0 110.063 172.087 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 56.5 tptt -56.35 -61.68 2.24 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.895 1.278 . . . . 0.0 109.122 167.439 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 19.5 mp0 -57.91 -42.34 84.54 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 118.826 -0.607 . . . . 0.0 110.36 -177.431 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -56.56 -40.52 75.32 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.495 1.118 . . . . 0.0 112.388 174.708 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 96.6 m -64.63 -45.01 88.67 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 123.338 0.655 . . . . 0.0 111.27 170.234 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -63.76 -26.33 68.59 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-O 117.434 -1.269 . . . . 0.0 111.958 -179.299 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.601 HD13 HG22 ' A' ' 31' ' ' VAL . 12.1 mm -57.06 -50.11 77.42 Favored 'Isoleucine or valine' 0 C--N 1.34 0.192 0 CA-C-N 120.439 1.472 . . . . 0.0 109.036 170.311 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 47.2 mm-40 -60.18 -49.54 77.24 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 -174.127 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 26.8 mttp -71.71 -37.51 70.64 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 124.272 1.029 . . . . 0.0 111.943 -176.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 11.3 t -53.23 -43.34 67.21 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 108.463 -0.939 . . . . 0.0 108.463 169.696 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.01 -45.61 90.26 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 -178.075 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.414 ' HA ' ' CE1' ' A' ' 23' ' ' TYR . 5.1 mm-40 -64.57 -41.78 96.06 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 123.852 0.861 . . . . 0.0 110.521 179.11 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.22 -11.93 17.44 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.172 0.804 . . . . 0.0 113.172 171.639 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 55.4 m-80 -126.32 9.65 7.3 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.067 1.347 . . . . 0.0 112.257 -175.333 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 12.6 m 54.48 42.01 31.61 Favored 'General case' 0 C--N 1.345 0.389 0 CA-C-O 122.68 1.229 . . . . 0.0 111.983 -178.16 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.414 ' CE1' ' HA ' ' A' ' 19' ' ' GLN 0.264 7.3 m-85 73.36 13.45 4.61 Favored 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 128.523 2.729 . . . . 0.0 114.526 168.046 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 66.7 mtm -69.6 85.02 0.44 Allowed 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 125.121 1.368 . . . . 0.0 109.761 169.842 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -54.46 -23.65 16.99 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.376 0.671 . . . . 0.0 111.538 171.09 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.1 m -52.73 -41.29 63.84 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 126.161 1.784 . . . . 0.0 112.151 170.082 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.3 mmtm -71.85 -47.8 50.54 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.28 1.032 . . . . 0.0 108.926 175.034 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.3 m -70.95 1.0 6.16 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 124.679 1.191 . . . . 0.0 112.919 -175.758 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 74.0 mm-40 -55.45 -29.53 58.84 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 119.635 1.107 . . . . 0.0 110.131 166.37 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.29 -59.25 5.21 Favored 'General case' 0 C--N 1.345 0.378 0 C-N-CA 124.946 1.298 . . . . 0.0 111.371 173.667 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.601 HG22 HD13 ' A' ' 14' ' ' ILE . 14.9 p -72.46 -29.15 30.18 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.819 0 C-N-CA 124.057 0.943 . . . . 0.0 109.909 -174.418 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 60.9 mt -60.69 -48.53 88.32 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 N-CA-C 106.263 -1.754 . . . . 0.0 106.263 169.077 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.407 ' HA ' ' HG3' ' A' ' 36' ' ' ARG . 0.9 OUTLIER -61.6 -28.99 69.75 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 119.637 1.108 . . . . 0.0 113.224 174.192 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 46.4 tt0 -67.11 -39.18 86.65 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 119.419 1.009 . . . . 0.0 109.973 172.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.532 HD13 ' CE1' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -60.07 -30.48 69.25 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 125.726 1.61 . . . . 0.0 109.084 175.294 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.407 ' HG3' ' HA ' ' A' ' 33' ' ' GLN . 18.9 mmt85 -71.89 -50.94 24.91 Favored 'General case' 0 C--N 1.343 0.292 0 C-N-CA 123.982 0.913 . . . . 0.0 108.567 -179.427 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -63.51 -29.78 71.0 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 124.755 1.222 . . . . 0.0 111.224 178.358 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 51.7 t -67.96 -55.44 12.73 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 167.406 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 44.3 t -59.61 -44.32 93.45 Favored 'General case' 0 C--N 1.328 -0.336 0 O-C-N 121.107 -0.995 . . . . 0.0 112.904 -170.253 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.25 -0.67 10.45 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 113.216 0.821 . . . . 0.0 113.216 -174.355 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.557 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 13.2 tt0 -93.62 -9.31 38.41 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 126.891 2.076 . . . . 0.0 111.914 -169.695 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.557 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 81.2 m-85 -133.84 163.08 53.72 Favored Pre-proline 0 N--CA 1.448 -0.537 0 C-N-CA 124.681 1.193 . . . . 0.0 111.625 -167.753 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -68.84 94.26 0.45 Allowed 'Trans proline' 0 N--CA 1.456 -0.723 0 N-CA-C 104.743 -2.83 . . . . 0.0 104.743 164.827 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.512 ' H ' ' HD2' ' A' ' 44' ' ' LYS . 2.7 mptp? -39.08 -28.74 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 128.498 2.719 . . . . 0.0 117.898 -164.803 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -56.27 -17.11 16.82 Favored Glycine 0 CA--C 1.54 1.636 0 CA-C-N 120.033 1.288 . . . . 0.0 113.597 169.162 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -54.4 -24.1 18.47 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 127.965 2.506 . . . . 0.0 111.52 168.63 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.6 t -140.5 132.26 27.4 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-O 123.355 1.55 . . . . 0.0 113.33 -172.344 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 20.9 t -70.54 -52.23 30.8 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.717 0 CA-C-N 112.723 -2.035 . . . . 0.0 108.887 176.548 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.9 m -59.38 -45.49 93.39 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 CA-C-O 118.828 -0.606 . . . . 0.0 109.542 -179.655 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 35.1 t -62.88 -33.27 74.94 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.684 1.594 . . . . 0.0 109.953 -179.902 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 54.4 m -66.39 -25.19 66.66 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.24 0.616 . . . . 0.0 111.391 173.043 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.38 -47.57 28.22 Favored Glycine 0 N--CA 1.473 1.163 0 CA-C-O 124.527 2.182 . . . . 0.0 109.638 166.588 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.532 ' CE1' HD13 ' A' ' 35' ' ' LEU . 1.6 t80 -66.58 -36.6 83.02 Favored 'General case' 0 N--CA 1.408 -2.528 0 CA-C-N 110.917 -2.642 . . . . 0.0 116.325 -164.659 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -63.21 -23.04 67.25 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 118.281 -0.866 . . . . 0.0 111.634 173.688 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 55.6 mttp -66.67 -46.14 76.65 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 119.393 0.997 . . . . 0.0 109.368 169.168 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -60.34 -46.59 89.36 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.511 1.124 . . . . 0.0 110.734 175.149 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -65.49 -42.99 91.57 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.167 1.387 . . . . 0.0 109.845 -176.513 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 33.7 tp10 -61.08 -43.75 98.41 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 118.431 0.559 . . . . 0.0 110.728 173.316 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -57.85 -45.2 86.59 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 122.567 0.347 . . . . 0.0 110.794 173.259 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -68.33 -37.24 80.36 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.513 0.725 . . . . 0.0 111.474 -178.058 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 19.5 mt -59.28 -20.32 53.4 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 124.747 1.219 . . . . 0.0 112.481 179.545 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 52.7 p -56.91 -53.88 52.91 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.885 0.766 . . . . 0.0 110.078 169.541 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 7.1 tpm_? -80.94 -36.11 31.39 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 123.51 0.724 . . . . 0.0 111.804 -179.574 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -75.7 55.69 0.87 Allowed 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.206 1.002 . . . . 0.0 109.517 173.331 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.9 m -174.75 173.14 2.85 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 129.333 3.053 . . . . 0.0 107.755 176.756 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -153.22 173.89 14.96 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.43 1.492 . . . . 0.0 108.695 175.113 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 8.7 m -70.24 61.86 0.21 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.773 2.029 . . . . 0.0 112.623 -177.094 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt . . . . . 0 CA--C 1.531 0.225 0 C-N-CA 125.761 1.624 . . . . 0.0 110.477 -178.195 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.8 mmt . . . . . 0 C--O 1.238 0.458 0 CA-C-O 118.626 -0.702 . . . . 0.0 109.197 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -65.96 106.19 0.92 Allowed 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 123.467 2.778 . . . . 0.0 110.302 179.538 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 89.0 mm-40 -69.38 151.59 45.97 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 123.556 0.742 . . . . 0.0 110.459 179.151 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.423 ' H ' ' NH2' ' A' ' 46' ' ' ARG . 31.2 mtmm -135.97 174.09 10.99 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.814 1.646 . . . . 0.0 109.922 -175.433 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -137.27 85.01 22.66 Favored Pre-proline 0 CA--C 1.536 0.428 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 168.09 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -55.9 -29.85 74.73 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 124.54 3.493 . . . . 0.0 113.325 -171.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.419 ' HB3' ' CD2' ' A' ' 35' ' ' LEU . 88.7 m -96.78 -12.62 23.42 Favored 'General case' 0 N--CA 1.433 -1.28 0 C-N-CA 125.922 1.689 . . . . 0.0 113.905 -168.504 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 18.9 tp60 -62.02 -24.7 67.22 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 117.98 0.355 . . . . 0.0 111.627 -176.151 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.4 ttpp -70.88 -45.86 63.63 Favored 'General case' 0 CA--C 1.532 0.275 0 O-C-N 121.522 -0.736 . . . . 0.0 111.043 173.422 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -63.26 -40.36 97.19 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.458 0.703 . . . . 0.0 109.892 178.78 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -53.15 -40.51 64.32 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 124.631 1.172 . . . . 0.0 113.046 169.868 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 72.2 m -58.71 -46.05 88.18 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 110.443 -0.206 . . . . 0.0 110.443 174.022 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -60.93 -27.9 68.55 Favored 'General case' 0 CA--C 1.528 0.127 0 CA-C-O 118.112 -0.947 . . . . 0.0 112.691 178.437 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 21.8 mm -57.92 -54.32 33.49 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.473 0 CA-C-N 119.444 1.02 . . . . 0.0 109.339 173.522 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 36.0 mm-40 -58.15 -55.14 38.78 Favored 'General case' 0 N--CA 1.444 -0.764 0 O-C-N 124.365 1.041 . . . . 0.0 108.864 -177.663 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.65 -32.96 74.62 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 118.209 -1.396 . . . . 0.0 112.045 -175.855 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 31.0 t -56.46 -47.5 79.04 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 119.483 1.038 . . . . 0.0 109.127 169.561 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.96 -46.57 87.74 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 123.59 0.756 . . . . 0.0 110.629 179.368 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -57.08 -44.2 82.89 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.878 0.871 . . . . 0.0 111.293 173.546 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.91 -11.81 57.41 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.039 0.935 . . . . 0.0 113.434 174.891 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 50.2 m-80 -126.42 9.47 7.21 Favored 'General case' 0 C--N 1.343 0.31 0 C-N-CA 124.507 1.123 . . . . 0.0 112.656 -172.543 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 14.8 m 58.12 40.51 25.06 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 122.445 1.117 . . . . 0.0 111.05 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.255 6.7 m-85 71.99 13.02 6.0 Favored 'General case' 0 N--CA 1.444 -0.736 0 C-N-CA 127.888 2.475 . . . . 0.0 114.791 168.448 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 63.4 mtm -69.61 86.92 0.47 Allowed 'General case' 0 N--CA 1.441 -0.91 0 C-N-CA 125.116 1.367 . . . . 0.0 109.917 170.678 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -56.05 -20.94 19.01 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.089 0.556 . . . . 0.0 111.7 170.05 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 6.4 m -58.25 -37.39 74.84 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 127.56 2.344 . . . . 0.0 113.014 169.333 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 56.9 mmtt -75.75 -48.68 20.8 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 124.252 1.021 . . . . 0.0 108.736 173.281 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 83.9 m -71.33 6.57 1.68 Allowed 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 125.338 1.455 . . . . 0.0 112.95 -177.687 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -52.14 -32.34 35.24 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 120.129 1.332 . . . . 0.0 111.914 169.416 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.56 -56.23 24.54 Favored 'General case' 0 C--N 1.342 0.282 0 C-N-CA 125.117 1.367 . . . . 0.0 111.649 173.035 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.8 p -75.49 -29.51 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.872 0 C-N-CA 124.004 0.922 . . . . 0.0 109.934 -174.763 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.431 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 1.5 mp -58.38 -49.35 82.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 N-CA-C 105.648 -1.982 . . . . 0.0 105.648 167.905 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.75 -22.77 62.55 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 118.896 0.771 . . . . 0.0 112.778 177.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -76.82 -41.44 44.33 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 119.39 -0.924 . . . . 0.0 110.406 173.43 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.455 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 2.7 mt -62.8 -30.85 71.78 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 119.364 0.984 . . . . 0.0 110.667 170.354 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.2 mmt85 -62.4 -57.68 10.4 Favored 'General case' 0 C--N 1.339 0.135 0 CA-C-N 119.73 1.15 . . . . 0.0 108.307 176.266 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 20.4 pttm -69.62 -23.09 63.45 Favored 'General case' 0 C--O 1.234 0.241 0 O-C-N 123.484 0.49 . . . . 0.0 111.46 -175.042 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 46.7 t -68.21 -54.15 19.83 Favored 'General case' 0 N--CA 1.439 -1.0 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 166.803 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.0 t -61.55 -50.59 72.04 Favored 'General case' 0 CA--C 1.516 -0.362 0 C-N-CA 124.691 1.196 . . . . 0.0 112.912 -169.33 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.76 0.06 3.65 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.988 0.915 . . . . 0.0 112.82 -173.803 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.556 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 10.6 tt0 -84.58 -8.87 58.75 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 127.041 2.136 . . . . 0.0 111.378 179.075 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.556 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 81.5 m-85 -137.46 155.76 75.31 Favored Pre-proline 0 N--CA 1.439 -1.011 0 C-N-CA 126.813 2.045 . . . . 0.0 110.87 -166.635 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -69.51 105.99 1.54 Allowed 'Trans proline' 0 N--CA 1.457 -0.653 0 N-CA-C 104.233 -3.026 . . . . 0.0 104.233 165.754 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 63.0 pttt -39.27 -34.25 0.18 Allowed 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 118.772 2.878 . . . . 0.0 118.772 -163.96 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -55.3 -18.75 14.78 Favored Glycine 0 CA--C 1.541 1.684 0 CA-C-N 120.346 1.43 . . . . 0.0 114.202 172.554 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.423 ' NH2' ' H ' ' A' ' 4' ' ' LYS . 4.2 tpm_? -57.82 -15.73 9.26 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 128.069 2.547 . . . . 0.0 112.598 169.056 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.1 t -148.49 137.52 21.72 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-O 122.816 1.293 . . . . 0.0 111.587 177.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 15.9 t -68.08 -53.25 31.0 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 CA-C-N 113.867 -1.515 . . . . 0.0 108.664 177.369 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.6 m -60.57 -42.29 91.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 CA-C-O 118.768 -0.634 . . . . 0.0 110.217 -177.501 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' CYS . . . . . 0.424 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 13.0 t -64.61 -36.36 83.99 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.953 1.701 . . . . 0.0 110.274 177.892 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.9 m -66.04 -27.18 67.91 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 119.081 -0.485 . . . . 0.0 110.686 172.226 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.69 -36.18 67.04 Favored Glycine 0 C--N 1.343 0.968 0 CA-C-O 123.072 1.373 . . . . 0.0 111.457 168.417 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.455 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.8 OUTLIER -73.51 -42.5 61.72 Favored 'General case' 0 N--CA 1.422 -1.869 0 N-CA-C 116.438 2.014 . . . . 0.0 116.438 -164.783 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -65.01 -21.62 66.87 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-O 118.472 -0.775 . . . . 0.0 110.359 174.82 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -80.7 -41.62 23.36 Favored 'General case' 0 C--N 1.35 0.602 0 CA-C-N 119.416 1.007 . . . . 0.0 110.161 166.516 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -58.67 -35.82 73.19 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.556 0.742 . . . . 0.0 111.182 179.331 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -58.67 -41.71 86.75 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.497 1.119 . . . . 0.0 110.424 176.151 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -63.26 -42.15 99.11 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 123.027 0.531 . . . . 0.0 109.896 175.324 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 50.7 tt0 -57.13 -52.6 64.65 Favored 'General case' 0 C--N 1.341 0.218 0 CA-C-N 118.075 0.398 . . . . 0.0 110.382 172.476 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -64.02 -39.59 94.44 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 121.513 -0.742 . . . . 0.0 110.94 -173.2 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.7 pp -75.5 -31.42 60.18 Favored 'General case' 0 C--N 1.342 0.264 0 CA-C-O 118.414 -0.803 . . . . 0.0 110.952 -177.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -72.76 -34.83 67.26 Favored 'General case' 0 C--N 1.343 0.325 0 CA-C-N 119.187 0.903 . . . . 0.0 110.738 172.657 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 13.5 mtm180 -67.8 -23.49 65.21 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 118.263 0.483 . . . . 0.0 111.269 169.359 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.4 tppt? 57.27 36.91 27.9 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 127.484 2.314 . . . . 0.0 111.258 -171.727 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 68.8 p -67.35 164.49 18.43 Favored 'General case' 0 CA--C 1.539 0.524 0 O-C-N 121.85 -0.531 . . . . 0.0 109.682 169.813 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.25 47.65 0.12 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.2 1.8 . . . . 0.0 114.442 -170.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 4.4 m -68.8 75.91 0.3 Allowed 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 126.444 1.898 . . . . 0.0 111.141 176.035 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 23.3 pttp . . . . . 0 CA--C 1.535 0.384 0 C-N-CA 125.222 1.409 . . . . 0.0 109.994 171.677 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.9 mtm . . . . . 0 CA--C 1.54 0.58 0 CA-C-O 119.643 -0.218 . . . . 0.0 110.589 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -84.95 58.18 5.12 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 123.078 2.519 . . . . 0.0 111.935 -168.89 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 21.1 mp0 -62.14 -24.73 67.33 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.311 -0.868 . . . . 0.0 111.463 169.665 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 38.0 tptt -147.45 -174.04 4.42 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 127.833 2.453 . . . . 0.0 105.564 168.7 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -131.04 90.54 38.92 Favored Pre-proline 0 N--CA 1.449 -0.493 0 N-CA-C 108.65 -0.871 . . . . 0.0 108.65 170.808 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -58.51 -31.03 93.47 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 123.988 3.125 . . . . 0.0 112.865 -174.465 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 56.2 m -93.75 -10.27 34.81 Favored 'General case' 0 N--CA 1.438 -1.041 0 C-N-CA 125.06 1.344 . . . . 0.0 112.523 -171.91 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.6 tp60 -62.74 -26.58 68.77 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 118.821 0.737 . . . . 0.0 110.623 178.344 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -56.48 -54.09 49.84 Favored 'General case' 0 C--O 1.226 -0.168 0 C-N-CA 123.745 0.818 . . . . 0.0 109.942 169.364 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -63.94 -46.79 83.15 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 118.47 -0.776 . . . . 0.0 109.604 -178.202 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -51.06 -40.05 57.42 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.772 1.229 . . . . 0.0 112.969 171.3 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 61.2 m -62.2 -43.0 99.81 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 119.407 -0.33 . . . . 0.0 110.642 172.2 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -64.73 -29.97 70.96 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 117.346 -1.311 . . . . 0.0 112.981 177.339 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.9 mp -57.39 -50.58 76.49 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 CA-C-N 121.021 1.737 . . . . 0.0 109.166 169.26 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 34.2 mm-40 -59.53 -54.59 44.79 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 178.584 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 53.6 mmtt -68.42 -30.8 69.78 Favored 'General case' 0 C--O 1.227 -0.116 0 C-N-CA 118.697 -1.201 . . . . 0.0 111.418 -172.807 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 19.9 t -56.21 -48.94 75.44 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 168.488 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.68 -47.35 82.58 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 118.866 -0.588 . . . . 0.0 110.523 178.808 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -56.74 -46.49 81.33 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.528 0.731 . . . . 0.0 111.199 174.618 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.71 -13.71 59.82 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.113 0.965 . . . . 0.0 113.518 175.759 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.6 m-80 -122.05 8.18 9.82 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 124.772 1.229 . . . . 0.0 111.946 -173.385 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 58.08 40.42 25.25 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 119.566 1.076 . . . . 0.0 110.853 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.261 7.0 m-85 72.29 14.27 5.51 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 127.816 2.447 . . . . 0.0 114.457 168.876 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 68.4 mtm -70.4 82.42 0.56 Allowed 'General case' 0 N--CA 1.441 -0.882 0 C-N-CA 125.212 1.405 . . . . 0.0 109.793 169.836 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -53.19 -24.14 10.17 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.366 1.066 . . . . 0.0 111.668 171.684 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.6 m -52.11 -40.08 60.76 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 126.517 1.927 . . . . 0.0 112.409 170.113 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 45.7 mmtt -72.16 -48.62 42.07 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 124.481 1.113 . . . . 0.0 108.706 174.813 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 78.9 m -73.59 1.38 10.21 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.299 1.44 . . . . 0.0 113.614 -173.763 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 53.4 mm-40 -52.65 -34.13 50.1 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 119.681 1.128 . . . . 0.0 111.222 169.123 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.23 -54.86 42.02 Favored 'General case' 0 C--N 1.343 0.291 0 C-N-CA 125.02 1.328 . . . . 0.0 111.387 175.011 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.0 p -75.59 -31.19 22.81 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.831 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.236 -173.034 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 75.2 mt -58.98 -45.9 91.87 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 N-CA-C 106.656 -1.609 . . . . 0.0 106.656 168.489 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.37 -27.57 62.42 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 120.969 -1.082 . . . . 0.0 113.052 173.662 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -76.47 -29.78 57.03 Favored 'General case' 0 N--CA 1.437 -1.097 0 C-N-CA 119.571 -0.851 . . . . 0.0 110.86 175.656 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.434 ' HB3' ' CE2' ' A' ' 53' ' ' PHE . 3.6 mt -64.45 -29.71 70.76 Favored 'General case' 0 C--N 1.343 0.311 0 CA-C-N 119.688 1.131 . . . . 0.0 109.213 168.648 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 16.7 mmt85 -66.03 -55.81 14.77 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 119.805 1.184 . . . . 0.0 108.719 -178.808 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.9 pttp -66.25 -27.11 67.71 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.157 -178.83 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 42.7 t -65.43 -54.83 22.93 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 168.397 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.1 t -62.55 -46.38 88.63 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 124.127 0.971 . . . . 0.0 112.137 -169.191 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.55 -4.02 10.44 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.003 -0.999 . . . . 0.0 112.879 -178.241 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.421 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 2.8 tp-100 -86.2 -6.2 59.04 Favored 'General case' 0 N--CA 1.439 -1.014 0 C-N-CA 124.851 1.26 . . . . 0.0 111.697 -178.753 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.421 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 72.3 m-85 -136.0 159.76 69.87 Favored Pre-proline 0 N--CA 1.446 -0.642 0 C-N-CA 124.434 1.094 . . . . 0.0 111.387 -168.949 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -67.76 109.24 1.84 Allowed 'Trans proline' 0 N--CA 1.455 -0.764 0 N-CA-C 104.778 -2.816 . . . . 0.0 104.778 165.389 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 38.5 mmtm -39.78 -38.43 0.65 Allowed 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 117.164 2.283 . . . . 0.0 117.164 -165.372 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.58 -17.23 25.86 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 123.854 0.74 . . . . 0.0 113.936 175.718 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 2.0 ttm180 -66.77 -8.08 25.83 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 126.946 2.098 . . . . 0.0 112.653 172.266 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 5.8 t -147.34 136.21 22.14 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 122.912 1.339 . . . . 0.0 112.076 174.415 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 19.9 t -71.73 -50.78 36.54 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.74 0 CA-C-N 113.615 -1.63 . . . . 0.0 108.762 176.717 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.4 m -60.34 -43.68 94.25 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.335 0 CA-C-O 118.402 -0.809 . . . . 0.0 109.835 179.722 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 25.5 t -63.22 -34.57 77.94 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.011 1.724 . . . . 0.0 110.451 178.131 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 48.7 m -65.73 -28.93 69.41 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 122.998 0.519 . . . . 0.0 110.875 171.588 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -67.68 -40.71 90.19 Favored Glycine 0 C--N 1.344 0.995 0 CA-C-O 124.167 1.982 . . . . 0.0 110.952 167.432 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.434 ' CE2' ' HB3' ' A' ' 35' ' ' LEU . 1.2 t80 -73.94 -40.29 63.18 Favored 'General case' 0 N--CA 1.417 -2.122 0 CA-C-N 111.786 -2.207 . . . . 0.0 116.128 -164.581 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -65.56 -29.35 69.95 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 118.324 -0.846 . . . . 0.0 110.638 170.929 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 50.4 tptt -70.79 -37.11 73.28 Favored 'General case' 0 C--N 1.347 0.496 0 CA-C-N 119.716 1.143 . . . . 0.0 110.662 169.883 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -57.46 -43.24 83.85 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.011 0.525 . . . . 0.0 110.21 169.955 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -65.08 -38.81 91.96 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.828 1.251 . . . . 0.0 110.276 179.972 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -60.93 -32.98 72.46 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 118.723 0.692 . . . . 0.0 111.831 173.398 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.0 tp10 -71.32 -45.89 61.93 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.512 0.596 . . . . 0.0 110.107 169.267 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -66.33 -36.67 83.51 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 117.736 -1.126 . . . . 0.0 112.606 -171.599 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 4.1 pp -59.49 -14.73 13.8 Favored 'General case' 0 C--N 1.343 0.308 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -179.239 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 2.9 t -104.23 -53.99 2.62 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 124.541 1.136 . . . . 0.0 108.819 167.183 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.7 tmm_? -53.17 -41.18 64.93 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.721 1.208 . . . . 0.0 112.616 -169.966 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.06 26.02 6.15 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 124.192 0.997 . . . . 0.0 112.644 173.797 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 56.4 p 63.27 176.7 0.16 Allowed 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 127.13 2.172 . . . . 0.0 111.966 -169.805 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.41 12.86 0.08 Allowed 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.965 1.468 . . . . 0.0 114.965 176.716 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 26.6 m -72.53 39.15 0.08 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 129.502 3.121 . . . . 0.0 112.093 177.383 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 2.5 pptp? . . . . . 0 N--CA 1.453 -0.312 0 C-N-CA 124.42 1.088 . . . . 0.0 110.918 178.679 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.5 mtt . . . . . 0 N--CA 1.449 -0.502 0 CA-C-O 118.228 -0.891 . . . . 0.0 109.003 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -67.16 -5.17 13.05 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.84 2.36 . . . . 0.0 116.499 -172.582 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 13.7 mp0 -64.05 -26.44 68.56 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 126.751 2.021 . . . . 0.0 110.023 167.655 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -124.28 86.97 2.65 Favored 'General case' 0 N--CA 1.444 -0.733 0 C-N-CA 126.912 2.085 . . . . 0.0 106.138 169.667 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.8 t0 -90.62 109.04 31.47 Favored Pre-proline 0 CA--C 1.539 0.553 0 N-CA-C 106.245 -1.761 . . . . 0.0 106.245 -174.824 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -68.67 -17.79 42.63 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 125.097 3.865 . . . . 0.0 113.672 -169.532 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.417 ' HB3' ' CD2' ' A' ' 35' ' ' LEU . 98.6 m -105.32 -9.3 17.7 Favored 'General case' 0 N--CA 1.435 -1.224 0 C-N-CA 127.056 2.143 . . . . 0.0 111.835 -170.451 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 16.9 tp60 -67.41 -22.48 65.53 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.704 -171.467 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -70.36 -46.79 63.41 Favored 'General case' 0 C--O 1.225 -0.232 0 O-C-N 121.449 -0.782 . . . . 0.0 110.057 173.687 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 19.0 mp0 -65.27 -40.57 94.1 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 127.255 2.222 . . . . 0.0 108.237 -172.583 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -52.16 -43.26 63.99 Favored 'General case' 0 C--N 1.34 0.166 0 C-N-CA 126.166 1.787 . . . . 0.0 112.707 169.232 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 84.0 m -60.99 -45.13 96.06 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.925 0.393 . . . . 0.0 110.299 175.709 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -63.83 -22.54 66.96 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 117.711 -1.137 . . . . 0.0 112.541 179.278 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 31.6 mm -59.17 -54.72 30.36 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.216 0 CA-C-N 120.408 1.458 . . . . 0.0 109.17 171.271 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -61.52 -51.79 67.15 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 -177.739 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 16.6 mtpp -67.9 -30.72 70.14 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 118.245 -0.884 . . . . 0.0 111.568 -174.725 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 15.6 t -58.51 -47.87 82.71 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-N 119.41 1.004 . . . . 0.0 108.512 168.787 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.72 -47.15 83.24 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 123.339 0.655 . . . . 0.0 110.392 178.997 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -58.45 -42.23 86.9 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.983 0.913 . . . . 0.0 111.681 174.195 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.63 -10.68 57.58 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 174.374 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -128.33 9.02 6.07 Favored 'General case' 0 C--N 1.344 0.362 0 CA-C-N 119.421 1.009 . . . . 0.0 112.59 -171.852 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 16.2 m 61.03 38.87 16.96 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 119.496 1.044 . . . . 0.0 110.39 177.777 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.265 7.1 m-85 72.2 14.81 5.52 Favored 'General case' 0 N--CA 1.444 -0.735 0 C-N-CA 127.656 2.382 . . . . 0.0 114.431 168.788 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 58.7 mtm -70.9 85.94 0.69 Allowed 'General case' 0 N--CA 1.441 -0.9 0 C-N-CA 124.84 1.256 . . . . 0.0 109.881 170.616 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -52.56 -24.85 9.0 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.265 1.026 . . . . 0.0 111.149 169.556 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.4 m -53.77 -38.83 64.86 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 127.511 2.324 . . . . 0.0 113.013 170.409 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.411 ' HA ' ' HE2' ' A' ' 27' ' ' LYS . 9.9 mmpt? -75.74 -47.6 25.33 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 173.45 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.6 m -71.89 2.64 5.22 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.626 1.17 . . . . 0.0 113.401 -174.568 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -52.98 -30.96 38.16 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 119.439 1.018 . . . . 0.0 110.695 167.763 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.65 -59.58 5.21 Favored 'General case' 0 C--N 1.346 0.444 0 C-N-CA 125.616 1.566 . . . . 0.0 111.68 173.7 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.5 p -71.29 -29.5 36.14 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.716 0 C-N-CA 123.761 0.825 . . . . 0.0 110.08 -174.27 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.573 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 71.7 mt -59.91 -49.85 82.34 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 N-CA-C 106.543 -1.651 . . . . 0.0 106.543 169.239 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -56.86 -25.3 56.19 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 119.451 1.023 . . . . 0.0 112.909 175.482 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -74.84 -41.55 59.66 Favored 'General case' 0 N--CA 1.44 -0.953 0 CA-C-N 118.925 0.784 . . . . 0.0 110.819 173.802 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.47 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 2.4 mt -62.92 -31.31 72.35 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-O 117.797 -1.097 . . . . 0.0 110.208 170.447 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.9 mmt85 -63.37 -56.4 16.64 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 120.067 1.303 . . . . 0.0 108.443 179.076 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.8 pttt -67.65 -28.4 67.68 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.951 -174.517 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 47.8 t -66.55 -54.51 22.86 Favored 'General case' 0 N--CA 1.44 -0.925 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 168.246 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.8 t -59.48 -50.06 75.4 Favored 'General case' 0 CA--C 1.512 -0.512 0 C-N-CA 124.332 1.053 . . . . 0.0 111.842 -169.573 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.11 -1.53 6.15 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.025 -0.989 . . . . 0.0 112.414 -174.608 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.511 ' HB3' ' CE2' ' A' ' 42' ' ' TYR . 2.0 tp-100 -81.9 -10.28 59.34 Favored 'General case' 0 N--CA 1.436 -1.158 0 C-N-CA 124.344 1.058 . . . . 0.0 111.578 174.76 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.511 ' CE2' ' HB3' ' A' ' 41' ' ' GLN . 68.7 m-85 -138.71 158.91 69.32 Favored Pre-proline 0 N--CA 1.445 -0.712 0 C-N-CA 124.187 0.995 . . . . 0.0 112.014 -167.666 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -72.1 147.62 48.92 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 121.735 1.623 . . . . 0.0 108.373 167.622 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -51.94 -42.93 63.23 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 -173.669 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.96 -14.24 23.11 Favored Glycine 0 CA--C 1.53 0.974 0 CA-C-O 119.032 -0.871 . . . . 0.0 113.257 -178.858 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.54 -17.08 56.71 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 118.894 1.347 . . . . 0.0 113.095 176.052 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 9.6 t -151.95 128.51 10.74 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-O 123.537 1.636 . . . . 0.0 112.901 -175.234 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 12.0 t -68.5 -50.85 52.56 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 CA-C-N 112.679 -2.055 . . . . 0.0 108.698 178.942 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 16.0 m -61.84 -43.53 97.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 CA-C-O 118.46 -0.781 . . . . 0.0 110.083 -178.578 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 18.5 t -63.86 -34.58 78.26 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.582 1.553 . . . . 0.0 110.227 177.886 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.0 m -65.07 -29.64 70.54 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 122.788 0.435 . . . . 0.0 110.675 171.99 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.1 -37.54 82.44 Favored Glycine 0 C--N 1.344 1.002 0 CA-C-O 123.089 1.383 . . . . 0.0 111.104 167.987 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.573 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 1.3 t80 -75.08 -40.25 60.25 Favored 'General case' 0 N--CA 1.417 -2.075 0 N-CA-C 117.097 2.258 . . . . 0.0 117.097 -163.74 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -62.33 -21.31 65.18 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.674 171.853 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 35.0 mtmm -81.2 -45.63 16.05 Favored 'General case' 0 C--N 1.348 0.543 0 CA-C-N 119.563 1.074 . . . . 0.0 110.425 167.016 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -58.71 -29.66 66.84 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.95 1.3 . . . . 0.0 112.132 -179.37 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -58.46 -53.73 54.99 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 126.458 1.903 . . . . 0.0 108.979 174.867 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -62.29 -41.66 98.69 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.316 0.646 . . . . 0.0 110.281 175.308 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -56.78 -37.71 71.49 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 124.114 0.965 . . . . 0.0 111.817 178.879 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -80.14 -49.28 11.91 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 118.305 -0.855 . . . . 0.0 110.917 174.57 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 47.2 mt -55.82 -41.06 73.65 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 118.823 0.738 . . . . 0.0 111.505 -174.899 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -70.17 -41.15 74.17 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 122.181 0.192 . . . . 0.0 111.441 179.439 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 13.6 mtp-105 -83.16 -34.87 25.91 Favored 'General case' 0 N--CA 1.461 0.117 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 -173.371 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 24.7 mtpp -123.07 16.98 10.01 Favored 'General case' 0 C--O 1.23 0.056 0 C-N-CA 125.512 1.525 . . . . 0.0 113.99 -165.302 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 8.4 t 61.06 -164.55 0.24 Allowed 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.499 1.52 . . . . 0.0 111.341 -173.461 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -64.61 54.52 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 128.552 2.741 . . . . 0.0 115.719 -168.988 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 51.0 m -67.66 41.16 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 127.15 2.18 . . . . 0.0 113.938 171.41 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 63.9 tttm . . . . . 0 N--CA 1.456 -0.133 0 C-N-CA 125.018 1.327 . . . . 0.0 109.461 175.715 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.3 mtt . . . . . 0 CA--C 1.536 0.441 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -68.31 108.33 1.76 Allowed 'Trans proline' 0 N--CA 1.458 -0.583 0 C-N-CA 123.188 2.592 . . . . 0.0 109.608 176.575 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -64.58 -36.18 83.39 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 122.09 -0.381 . . . . 0.0 110.956 -176.107 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -74.37 33.07 0.09 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 127.307 2.243 . . . . 0.0 112.872 -178.819 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.0 t0 -128.36 97.48 28.28 Favored Pre-proline 0 N--CA 1.446 -0.669 0 C-N-CA 126.761 2.024 . . . . 0.0 108.935 -173.973 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -55.25 -34.58 88.75 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 124.091 3.194 . . . . 0.0 112.77 -173.695 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 85.7 m -94.9 -13.09 25.76 Favored 'General case' 0 N--CA 1.436 -1.168 0 C-N-CA 125.403 1.481 . . . . 0.0 113.581 -168.305 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.1 tp60 -61.29 -26.57 67.87 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 122.99 0.516 . . . . 0.0 110.803 -179.968 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.2 ttpp -62.29 -54.31 42.57 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.521 0.728 . . . . 0.0 110.377 169.971 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 27.1 mm-40 -59.12 -44.83 92.04 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.405 0.682 . . . . 0.0 110.107 -177.293 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -51.26 -42.58 61.17 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 125.728 1.611 . . . . 0.0 112.626 170.846 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.425 ' HB3' ' HE2' ' A' ' 16' ' ' LYS . 93.8 m -61.66 -46.27 90.45 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 117.854 0.297 . . . . 0.0 110.931 173.004 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -62.59 -22.22 66.21 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 117.662 -1.161 . . . . 0.0 112.633 179.091 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 27.3 mm -57.78 -53.61 42.67 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.218 0 CA-C-N 120.397 1.453 . . . . 0.0 109.614 171.796 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 -58.64 -55.85 29.75 Favored 'General case' 0 N--CA 1.445 -0.678 0 O-C-N 124.19 0.932 . . . . 0.0 109.002 -179.316 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.425 ' HE2' ' HB3' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -66.65 -31.54 72.28 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 118.807 -1.157 . . . . 0.0 112.138 -175.004 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 24.1 t -55.67 -48.72 74.58 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 119.491 1.041 . . . . 0.0 108.758 169.18 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.44 -46.7 86.02 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-O 118.863 -0.589 . . . . 0.0 110.48 179.533 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -57.03 -46.33 82.47 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.419 0.688 . . . . 0.0 111.34 174.402 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.49 -13.03 57.95 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.262 1.025 . . . . 0.0 113.4 175.66 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -123.21 8.54 9.16 Favored 'General case' 0 C--N 1.342 0.26 0 C-N-CA 124.66 1.184 . . . . 0.0 111.959 -173.333 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.3 m 58.23 40.13 25.08 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 119.636 1.107 . . . . 0.0 110.863 179.415 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.26 7.0 m-85 72.19 13.98 5.65 Favored 'General case' 0 N--CA 1.443 -0.796 0 C-N-CA 127.957 2.503 . . . . 0.0 114.499 168.902 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 67.0 mtm -69.93 84.72 0.5 Allowed 'General case' 0 N--CA 1.44 -0.955 0 C-N-CA 125.204 1.402 . . . . 0.0 109.837 170.002 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -53.79 -25.07 17.48 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.502 0.721 . . . . 0.0 111.524 171.105 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.2 m -53.1 -38.64 62.77 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 126.413 1.885 . . . . 0.0 112.631 170.691 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.8 mmtm -72.95 -47.73 42.95 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.267 1.027 . . . . 0.0 108.671 173.454 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.3 m -73.74 3.24 6.76 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 124.797 1.239 . . . . 0.0 113.637 -173.074 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 64.2 mm-40 -54.82 -29.72 55.46 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.2 -0.937 . . . . 0.0 110.542 167.067 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.71 -55.39 35.75 Favored 'General case' 0 C--N 1.345 0.4 0 C-N-CA 125.567 1.547 . . . . 0.0 111.708 172.606 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.5 p -75.81 -29.37 20.14 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 C-N-CA 123.605 0.762 . . . . 0.0 110.16 -173.467 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 59.2 mt -61.04 -46.78 96.0 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 N-CA-C 106.058 -1.83 . . . . 0.0 106.058 168.213 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.81 -26.58 62.18 Favored 'General case' 0 N--CA 1.453 -0.304 0 O-C-N 120.853 -1.155 . . . . 0.0 113.436 172.884 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -76.39 -32.32 58.49 Favored 'General case' 0 N--CA 1.432 -1.33 0 C-N-CA 119.492 -0.883 . . . . 0.0 110.743 175.705 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.8 mt -64.02 -32.83 74.51 Favored 'General case' 0 C--O 1.22 -0.455 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 168.46 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.4 mmt85 -64.71 -57.23 9.55 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 119.913 1.233 . . . . 0.0 109.24 -179.119 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.9 pttp -64.95 -29.64 70.58 Favored 'General case' 0 C--O 1.233 0.186 0 O-C-N 123.543 0.527 . . . . 0.0 111.087 -176.082 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 51.1 t -65.27 -54.19 32.95 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 168.729 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 48.7 t -62.6 -47.07 85.39 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 121.514 -0.741 . . . . 0.0 111.838 -169.921 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.53 -0.89 7.34 Favored 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 124.484 1.114 . . . . 0.0 112.429 -176.728 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.465 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 1.8 tp-100 -77.28 -11.52 59.84 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-N 119.1 0.864 . . . . 0.0 111.572 171.667 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.465 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 54.1 m-85 -141.44 160.64 56.25 Favored Pre-proline 0 N--CA 1.438 -1.053 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -164.23 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -69.82 114.85 3.85 Favored 'Trans proline' 0 N--CA 1.455 -0.758 0 N-CA-C 105.283 -2.622 . . . . 0.0 105.283 165.069 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.43 -29.57 1.14 Allowed 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 117.586 2.439 . . . . 0.0 117.586 -166.577 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -54.1 -17.16 7.16 Favored Glycine 0 CA--C 1.538 1.509 0 CA-C-N 119.601 1.091 . . . . 0.0 114.075 171.852 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.4 ' HG2' ' CG ' ' A' ' 42' ' ' TYR . 8.3 tpm_? -52.16 -29.15 20.81 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 127.589 2.356 . . . . 0.0 112.386 168.017 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.4 t -149.25 139.82 22.55 Favored 'General case' 0 N--CA 1.439 -1.012 0 CA-C-O 122.804 1.288 . . . . 0.0 112.048 -168.277 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.1 t -67.79 -55.03 18.4 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.658 0 CA-C-N 113.747 -1.569 . . . . 0.0 108.704 176.655 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.3 m -61.19 -43.2 95.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 CA-C-O 118.382 -0.818 . . . . 0.0 109.954 -177.106 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 29.5 t -64.57 -32.07 73.56 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.4 1.48 . . . . 0.0 110.18 178.934 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 52.3 m -67.25 -26.93 66.82 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 119.075 -0.488 . . . . 0.0 110.893 171.742 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -71.0 -36.15 64.58 Favored Glycine 0 C--N 1.345 1.05 0 CA-C-O 123.798 1.776 . . . . 0.0 111.092 167.288 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -78.47 -40.3 35.91 Favored 'General case' 0 N--CA 1.412 -2.339 0 N-CA-C 116.293 1.96 . . . . 0.0 116.293 -163.846 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -63.14 -29.25 70.65 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 119.483 -0.887 . . . . 0.0 110.342 170.858 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 19.4 tptp -69.02 -44.7 72.19 Favored 'General case' 0 C--N 1.349 0.564 0 CA-C-N 119.383 0.992 . . . . 0.0 110.408 170.513 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -55.05 -51.05 67.55 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.512 1.125 . . . . 0.0 109.6 176.123 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 72.1 tt0 -62.14 -35.89 80.14 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 126.255 1.822 . . . . 0.0 110.934 -178.249 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -61.28 -36.56 80.4 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.168 0.587 . . . . 0.0 111.286 173.834 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -63.44 -45.33 91.36 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-N 118.965 0.802 . . . . 0.0 109.674 171.099 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -68.71 -24.58 64.49 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 117.655 -1.164 . . . . 0.0 112.3 -171.791 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 49.0 mt -50.8 -22.29 2.08 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.204 1.002 . . . . 0.0 113.004 172.524 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 38.6 p -57.13 -70.1 0.14 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.28 1.032 . . . . 0.0 109.861 168.972 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -55.02 -50.91 67.86 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 126.391 1.877 . . . . 0.0 110.579 175.392 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.3 ttpm? -75.74 39.77 0.18 Allowed 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 128.085 2.554 . . . . 0.0 110.839 178.847 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.1 m -66.23 156.9 32.88 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 123.786 0.834 . . . . 0.0 110.076 171.606 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -157.5 -178.14 7.12 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 126.121 1.768 . . . . 0.0 107.798 176.777 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 71.9 p -70.85 65.1 0.33 Allowed 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.912 1.285 . . . . 0.0 109.925 169.589 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 90.6 mttt . . . . . 0 C--O 1.232 0.132 0 C-N-CA 125.318 1.447 . . . . 0.0 109.527 -176.111 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.546 0.803 0 CA-C-O 119.261 -0.4 . . . . 0.0 111.105 . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -50.51 123.64 11.72 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 123.151 2.567 . . . . 0.0 110.866 170.433 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 67.8 mm-40 -75.94 45.91 0.36 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.675 1.59 . . . . 0.0 112.808 -169.891 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -68.43 158.7 33.11 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 167.635 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 47.3 t0 -93.3 102.01 6.65 Favored Pre-proline 0 CA--C 1.54 0.584 0 C-N-CA 123.217 0.607 . . . . 0.0 109.589 -173.132 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.54 -25.55 29.5 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 123.629 2.886 . . . . 0.0 112.4 -176.14 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 66.0 m -92.66 -11.51 33.93 Favored 'General case' 0 N--CA 1.435 -1.192 0 C-N-CA 124.518 1.127 . . . . 0.0 110.89 -170.699 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 21.4 tp60 -64.34 -25.0 67.84 Favored 'General case' 0 N--CA 1.442 -0.83 0 C-N-CA 123.36 0.664 . . . . 0.0 110.686 179.599 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -62.14 -53.83 49.79 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 123.477 0.711 . . . . 0.0 110.02 169.115 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -62.97 -38.89 92.9 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.043 0.537 . . . . 0.0 109.675 -176.662 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.32 -44.38 72.0 Favored 'General case' 0 C--N 1.342 0.272 0 C-N-CA 125.327 1.451 . . . . 0.0 112.222 169.784 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 85.3 m -58.54 -45.82 88.12 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 117.734 0.243 . . . . 0.0 110.531 173.573 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.0 mm-40 -67.3 -16.63 64.38 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 117.495 -1.24 . . . . 0.0 112.681 -179.864 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 42.2 mm -59.85 -54.3 36.59 Favored 'Isoleucine or valine' 0 C--N 1.34 0.17 0 CA-C-N 121.09 1.768 . . . . 0.0 107.847 169.118 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 50.9 mm-40 -57.27 -52.77 63.98 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.249 -0.887 . . . . 0.0 109.202 174.291 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 18.5 mmmt -65.34 -32.32 73.9 Favored 'General case' 0 C--N 1.334 -0.073 0 C-N-CA 118.741 -1.184 . . . . 0.0 111.757 -172.913 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 17.5 t -57.69 -51.45 69.47 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 169.72 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.65 -47.77 73.13 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.968 0.907 . . . . 0.0 110.876 178.229 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.461 ' HA ' ' CE1' ' A' ' 23' ' ' TYR . 0.6 OUTLIER -55.9 -45.36 78.68 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.024 0.93 . . . . 0.0 111.473 174.07 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.88 -10.99 60.57 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 114.381 1.252 . . . . 0.0 114.381 176.577 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -126.37 16.51 7.7 Favored 'General case' 0 C--N 1.343 0.321 0 CA-C-N 119.806 1.185 . . . . 0.0 113.749 -168.401 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 17.6 m 60.17 34.68 21.1 Favored 'General case' 0 C--N 1.345 0.401 0 CA-C-N 120.523 1.511 . . . . 0.0 110.285 -179.192 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.461 ' CE1' ' HA ' ' A' ' 19' ' ' GLN . 46.4 m-85 67.33 16.43 10.09 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 126.832 2.053 . . . . 0.0 113.719 168.406 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 65.2 mtm -73.7 90.98 1.86 Allowed 'General case' 0 N--CA 1.439 -0.987 0 C-N-CA 126.168 1.787 . . . . 0.0 109.114 175.368 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -54.68 -23.56 17.97 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.982 -0.449 . . . . 0.0 111.469 170.862 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.2 m -53.73 -41.32 66.94 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 126.588 1.955 . . . . 0.0 112.412 170.299 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 61.2 mmtt -71.29 -45.99 61.83 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 124.103 0.961 . . . . 0.0 108.891 173.581 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 86.3 m -73.97 3.47 6.79 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 124.336 1.054 . . . . 0.0 113.012 -172.88 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 79.8 mm-40 -56.45 -27.74 57.66 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.467 -0.771 . . . . 0.0 110.541 166.234 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.31 -60.46 3.78 Favored 'General case' 0 C--N 1.345 0.39 0 C-N-CA 125.403 1.481 . . . . 0.0 111.423 172.003 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.1 p -71.62 -25.92 25.35 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 C-N-CA 123.835 0.854 . . . . 0.0 110.004 -175.093 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 17.0 mt -60.02 -52.46 60.9 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 N-CA-C 106.684 -1.599 . . . . 0.0 106.684 168.101 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.452 ' HA ' ' CG ' ' A' ' 36' ' ' ARG . 8.6 tt0 -55.25 -36.65 66.29 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-O 118.792 -0.623 . . . . 0.0 110.305 178.588 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -65.25 -41.99 93.74 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 118.685 0.675 . . . . 0.0 111.703 176.065 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.538 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 0.7 OUTLIER -61.44 -38.59 87.72 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-O 117.005 -1.474 . . . . 0.0 110.418 173.236 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.533 HH21 ' NH2' ' A' ' 63' ' ' ARG 0.275 9.3 ptt85 -70.08 -39.76 75.4 Favored 'General case' 0 C--N 1.341 0.226 0 CA-C-N 120.66 1.573 . . . . 0.0 110.605 -179.865 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.8 mmtp -64.14 -37.1 86.22 Favored 'General case' 0 C--N 1.344 0.34 0 CA-C-N 118.716 0.689 . . . . 0.0 111.188 175.859 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 49.3 t -60.66 -53.18 60.5 Favored 'General case' 0 C--O 1.22 -0.448 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 170.528 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 39' ' ' CYS . . . . . 0.466 ' HA ' HH12 ' A' ' 46' ' ' ARG . 42.3 t -57.56 -44.97 85.64 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 125.306 1.443 . . . . 0.0 113.142 -169.646 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.33 -1.11 25.15 Favored 'General case' 0 N--CA 1.441 -0.902 0 O-C-N 124.67 1.231 . . . . 0.0 112.631 -176.268 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.457 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 3.5 tp-100 -91.86 -1.85 57.13 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 124.23 1.012 . . . . 0.0 112.754 -168.827 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.555 ' HB2' ' CZ ' ' A' ' 46' ' ' ARG . 84.7 m-85 -142.56 165.97 23.66 Favored Pre-proline 0 N--CA 1.443 -0.781 0 C-N-CA 125.985 1.714 . . . . 0.0 110.641 -167.474 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -61.93 139.93 82.21 Favored 'Trans proline' 0 CA--C 1.538 0.68 0 C-N-CA 121.798 1.665 . . . . 0.0 109.433 169.164 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm -71.44 -5.51 33.43 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 114.699 1.37 . . . . 0.0 114.699 -169.186 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -86.86 -12.79 68.01 Favored Glycine 0 CA--C 1.533 1.179 0 CA-C-O 118.636 -1.091 . . . . 0.0 113.669 169.933 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.555 ' CZ ' ' HB2' ' A' ' 42' ' ' TYR . 0.0 OUTLIER -74.39 -9.85 59.0 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.768 1.784 . . . . 0.0 112.757 -173.596 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.407 ' HB2' ' HD2' ' A' ' 46' ' ' ARG . 16.0 t -145.4 146.26 31.48 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 120.909 -1.119 . . . . 0.0 112.053 -174.656 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 23.6 t -84.26 -55.11 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 C-N-CA 126.177 1.791 . . . . 0.0 108.826 173.103 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.8 m -58.22 -41.35 80.75 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 118.212 0.46 . . . . 0.0 110.745 -173.724 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 50' ' ' CYS . . . . . 0.412 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 9.2 t -64.22 -34.48 78.19 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.281 1.433 . . . . 0.0 109.871 -179.928 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.1 p -64.94 -27.16 68.65 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 121.995 -0.44 . . . . 0.0 111.016 174.065 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.09 -45.12 58.01 Favored Glycine 0 C--N 1.348 1.196 0 CA-C-O 123.902 1.834 . . . . 0.0 110.172 168.391 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.538 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.6 OUTLIER -63.73 -39.74 95.04 Favored 'General case' 0 N--CA 1.415 -2.19 0 CA-C-N 111.937 -2.131 . . . . 0.0 115.354 -167.276 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -64.08 -22.53 66.97 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 118.649 -0.691 . . . . 0.0 111.079 178.747 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm -73.46 -38.88 65.31 Favored 'General case' 0 C--N 1.345 0.398 0 CA-C-N 119.186 0.903 . . . . 0.0 110.736 168.743 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -66.69 -28.53 68.52 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.808 -0.557 . . . . 0.0 111.826 171.972 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -64.6 -34.48 78.36 Favored 'General case' 0 C--O 1.227 -0.127 0 O-C-N 121.229 -0.919 . . . . 0.0 110.675 177.384 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -59.38 -39.56 83.73 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 118.411 0.55 . . . . 0.0 110.607 171.353 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -66.39 -47.4 73.43 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 122.538 0.335 . . . . 0.0 111.561 171.445 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -70.21 -22.85 62.88 Favored 'General case' 0 CA--C 1.522 -0.121 0 C-N-CA 124.113 0.965 . . . . 0.0 112.588 -173.63 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 15.2 mt -57.42 -11.53 1.97 Allowed 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 124.257 1.023 . . . . 0.0 113.211 172.883 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 27.2 p -62.95 -62.4 1.74 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.211 1.005 . . . . 0.0 108.862 166.496 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.533 ' NH2' HH21 ' A' ' 36' ' ' ARG . 11.8 ttp180 -60.74 -45.45 94.24 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 127.268 2.227 . . . . 0.0 111.96 174.547 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 22.7 pttp 42.73 15.36 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 131.323 3.849 . . . . 0.0 118.354 -175.598 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.4 t 54.64 -167.0 0.09 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.064 1.346 . . . . 0.0 111.117 -169.07 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.56 22.75 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.038 1.735 . . . . 0.0 115.021 -176.947 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 13.1 m -71.29 32.24 0.05 OUTLIER 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 129.31 3.044 . . . . 0.0 113.328 -175.829 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 13.0 mptt . . . . . 0 N--CA 1.446 -0.66 0 C-N-CA 125.983 1.713 . . . . 0.0 108.913 -175.633 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.7 mtp . . . . . 0 CA--C 1.537 0.452 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -75.42 61.2 5.94 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.605 2.87 . . . . 0.0 110.997 176.614 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -68.59 156.38 38.2 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.449 1.1 . . . . 0.0 110.471 177.625 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -74.36 55.35 0.61 Allowed 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.74 1.616 . . . . 0.0 110.551 170.994 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -128.12 105.64 20.01 Favored Pre-proline 0 N--CA 1.441 -0.883 0 C-N-CA 129.363 3.065 . . . . 0.0 108.343 -167.46 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -60.47 -16.63 43.21 Favored 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 124.31 3.34 . . . . 0.0 114.948 -173.65 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 64.2 m -108.57 -6.97 15.82 Favored 'General case' 0 N--CA 1.441 -0.92 0 C-N-CA 127.027 2.131 . . . . 0.0 112.272 -170.465 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 8.0 tp60 -67.89 -22.79 65.07 Favored 'General case' 0 N--CA 1.447 -0.597 0 O-C-N 121.615 -0.678 . . . . 0.0 112.278 -173.018 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 47.5 tptt -67.26 -49.56 63.93 Favored 'General case' 0 C--O 1.226 -0.143 0 CA-C-O 122.028 0.918 . . . . 0.0 109.446 173.456 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 20.4 mp0 -61.64 -43.13 99.44 Favored 'General case' 0 N--CA 1.442 -0.86 0 C-N-CA 127.641 2.377 . . . . 0.0 107.995 -173.962 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -53.78 -41.32 67.1 Favored 'General case' 0 C--N 1.341 0.213 0 C-N-CA 126.562 1.945 . . . . 0.0 114.016 169.797 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.0 m -63.27 -44.84 93.98 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 122.408 0.283 . . . . 0.0 110.263 173.716 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -64.83 -24.88 67.68 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 117.688 -1.148 . . . . 0.0 112.243 179.739 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 37.5 mm -56.54 -50.87 71.36 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.221 0 CA-C-N 120.273 1.397 . . . . 0.0 109.4 169.453 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 45.8 mm-40 -59.97 -56.28 23.68 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 106.971 -1.492 . . . . 0.0 106.971 -175.145 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 44.5 mttt -70.41 -30.19 67.0 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 118.182 -0.913 . . . . 0.0 111.233 -171.618 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 18.9 t -57.26 -47.06 82.37 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 169.185 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.26 -45.75 90.36 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 118.435 -0.793 . . . . 0.0 110.169 179.649 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -58.29 -45.68 87.5 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 119.328 0.967 . . . . 0.0 111.301 174.255 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.93 -13.94 58.53 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 175.862 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -123.86 9.25 8.8 Favored 'General case' 0 C--N 1.343 0.322 0 C-N-CA 124.302 1.041 . . . . 0.0 112.24 -172.928 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.4 m 58.03 40.45 25.39 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 122.404 1.097 . . . . 0.0 110.842 179.369 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.265 6.8 m-85 72.25 14.36 5.53 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 127.801 2.44 . . . . 0.0 114.428 168.79 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 63.0 mtm -69.45 86.27 0.44 Allowed 'General case' 0 N--CA 1.442 -0.843 0 C-N-CA 125.175 1.39 . . . . 0.0 110.329 170.122 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -54.36 -22.97 13.68 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.457 1.103 . . . . 0.0 111.323 169.486 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.6 m -58.02 -40.64 81.35 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 127.027 2.131 . . . . 0.0 112.631 170.085 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.7 mmtm -72.91 -47.73 43.2 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 124.138 0.975 . . . . 0.0 108.561 174.375 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.0 m -70.14 3.33 2.87 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.034 1.334 . . . . 0.0 113.424 -176.791 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.545 HE22 ' NH1' ' A' ' 63' ' ' ARG . 85.1 mm-40 -53.37 -31.7 45.86 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 119.304 0.956 . . . . 0.0 111.122 167.204 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.64 -50.16 74.93 Favored 'General case' 0 C--N 1.344 0.362 0 C-N-CA 125.028 1.331 . . . . 0.0 112.116 174.851 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.7 p -80.91 -29.96 11.66 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.809 0 C-N-CA 123.391 0.677 . . . . 0.0 109.845 -174.256 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.569 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 68.8 mt -63.25 -40.66 89.9 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 169.366 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.67 -34.71 59.61 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 123.727 0.811 . . . . 0.0 112.001 170.232 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -74.85 -42.8 57.25 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 119.806 -0.758 . . . . 0.0 110.846 179.504 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.458 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 2.4 mt -64.23 -30.9 71.94 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 118.276 -0.869 . . . . 0.0 110.311 174.425 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.22 -61.88 2.27 Favored 'General case' 0 CA--C 1.518 -0.269 0 C-N-CA 124.437 1.095 . . . . 0.0 108.756 175.661 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -64.58 -28.12 69.41 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 114.372 -1.286 . . . . 0.0 110.66 -173.499 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 49.4 t -66.28 -55.37 16.41 Favored 'General case' 0 N--CA 1.442 -0.83 0 C-N-CA 123.511 0.724 . . . . 0.0 109.258 168.273 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 47.8 t -60.0 -43.81 94.95 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 123.94 0.896 . . . . 0.0 112.516 -170.859 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.85 -4.32 15.85 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.845 -1.07 . . . . 0.0 113.006 -176.313 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.458 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 3.1 tp-100 -91.7 -4.82 54.67 Favored 'General case' 0 N--CA 1.437 -1.084 0 C-N-CA 125.355 1.462 . . . . 0.0 112.122 -172.6 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.458 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 78.9 m-85 -139.15 161.32 58.3 Favored Pre-proline 0 N--CA 1.446 -0.628 0 C-N-CA 124.132 0.973 . . . . 0.0 112.244 -168.133 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -69.48 98.99 0.69 Allowed 'Trans proline' 0 N--CA 1.456 -0.709 0 N-CA-C 105.096 -2.694 . . . . 0.0 105.096 165.384 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.514 ' H ' ' HD2' ' A' ' 44' ' ' LYS . 2.8 mptp? -39.34 -30.69 0.07 Allowed 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 117.904 2.557 . . . . 0.0 117.904 -165.556 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -54.81 -18.44 11.28 Favored Glycine 0 CA--C 1.541 1.659 0 CA-C-N 120.219 1.372 . . . . 0.0 114.097 170.021 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.0 tpm_? -55.8 -24.04 33.63 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 127.95 2.5 . . . . 0.0 112.053 168.957 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.5 t -144.64 130.16 18.93 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-O 123.387 1.565 . . . . 0.0 112.497 -172.298 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.7 t -69.82 -49.8 54.35 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.758 0 CA-C-N 112.952 -1.931 . . . . 0.0 108.72 176.677 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.4 m -62.58 -42.04 94.38 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-O 118.512 -0.756 . . . . 0.0 110.352 -178.319 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 50' ' ' CYS . . . . . 0.427 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 7.7 t -64.82 -35.28 80.6 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.757 1.623 . . . . 0.0 110.191 176.235 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.3 m -65.44 -28.9 69.56 Favored 'General case' 0 CA--C 1.535 0.398 0 O-C-N 122.082 -0.386 . . . . 0.0 110.525 171.727 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.56 -32.99 71.42 Favored Glycine 0 C--N 1.345 1.052 0 CA-C-O 122.801 1.223 . . . . 0.0 111.366 167.939 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.569 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 0.9 OUTLIER -80.21 -42.08 23.98 Favored 'General case' 0 N--CA 1.422 -1.839 0 N-CA-C 116.103 1.89 . . . . 0.0 116.103 -165.211 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -63.28 -26.04 68.59 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 119.841 -0.744 . . . . 0.0 110.404 171.014 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.424 ' HA ' ' HE3' ' A' ' 55' ' ' LYS . 1.3 tpmt? -73.38 -40.25 64.49 Favored 'General case' 0 C--N 1.347 0.477 0 CA-C-N 118.962 0.801 . . . . 0.0 110.454 168.641 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -59.31 -40.35 85.97 Favored 'General case' 0 C--O 1.221 -0.419 0 CA-C-N 118.48 0.582 . . . . 0.0 110.408 173.023 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -63.51 -40.83 98.09 Favored 'General case' 0 C--N 1.332 -0.165 0 C-N-CA 125.036 1.334 . . . . 0.0 110.155 179.128 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -58.69 -43.74 90.07 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 118.134 0.425 . . . . 0.0 110.5 170.283 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -61.16 -39.79 91.43 Favored 'General case' 0 CA--C 1.535 0.403 0 O-C-N 121.86 -0.525 . . . . 0.0 111.985 173.061 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -64.15 -29.46 70.58 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 124.646 1.178 . . . . 0.0 111.154 -178.466 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 89.8 mt -55.01 -34.42 63.43 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 118.862 0.755 . . . . 0.0 111.296 170.067 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 24.2 p -84.5 -49.08 8.94 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 124.693 1.197 . . . . 0.0 111.082 177.522 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.545 ' NH1' HE22 ' A' ' 29' ' ' GLN . 8.9 ttp180 -70.42 -29.32 65.89 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.427 1.491 . . . . 0.0 112.343 -171.832 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 53.8 mttp 60.61 168.07 0.09 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 129.809 3.243 . . . . 0.0 114.847 173.543 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 85.1 p 168.9 -177.72 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 130.683 3.593 . . . . 0.0 106.293 -176.041 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.8 9.03 0.98 Allowed 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 114.524 1.305 . . . . 0.0 114.524 169.18 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 7.7 t -140.9 37.13 1.78 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 128.2 2.6 . . . . 0.0 109.297 170.994 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 33.7 mmtp . . . . . 0 C--N 1.344 0.351 0 C-N-CA 126.213 1.805 . . . . 0.0 111.128 -172.094 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.446 -0.675 0 CA-C-O 119.301 -0.381 . . . . 0.0 111.083 . . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -80.85 -175.15 2.53 Favored 'Trans proline' 0 CA--C 1.545 1.026 0 C-N-CA 123.559 2.839 . . . . 0.0 110.53 169.098 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 59.43 -58.55 0.06 Allowed 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 129.658 3.183 . . . . 0.0 117.276 169.378 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.9 mppt? -64.57 160.52 19.39 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.656 1.182 . . . . 0.0 110.267 -171.989 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.2 t0 -94.46 102.1 7.99 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 124.94 1.296 . . . . 0.0 108.237 177.574 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -61.52 -30.95 87.23 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 125.247 3.964 . . . . 0.0 113.056 -172.36 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.441 ' HB3' ' CD2' ' A' ' 35' ' ' LEU . 87.9 m -94.16 -15.55 24.53 Favored 'General case' 0 N--CA 1.436 -1.163 0 C-N-CA 125.134 1.374 . . . . 0.0 112.497 -168.552 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 21.7 tp60 -61.15 -24.62 66.42 Favored 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 123.6 0.76 . . . . 0.0 111.181 -179.958 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -63.42 -56.13 18.71 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.48 0.712 . . . . 0.0 110.215 169.018 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -60.6 -37.85 82.75 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.475 0.71 . . . . 0.0 110.389 -176.423 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.41 -39.84 67.7 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 125.48 1.512 . . . . 0.0 113.759 170.039 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.1 m -61.08 -45.18 95.78 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 123.052 0.22 . . . . 0.0 110.445 171.873 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 32.0 mm-40 -63.86 -27.82 69.43 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-O 117.801 -1.095 . . . . 0.0 112.186 179.417 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.414 HD13 HG13 ' A' ' 31' ' ' VAL . 43.1 mm -56.33 -50.62 70.88 Favored 'Isoleucine or valine' 0 C--N 1.341 0.227 0 CA-C-N 120.106 1.321 . . . . 0.0 109.516 170.541 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 47.4 mm-40 -59.13 -56.08 26.75 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 107.218 -1.401 . . . . 0.0 107.218 -175.099 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 24.7 mttm -70.79 -30.67 67.2 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 118.366 -0.826 . . . . 0.0 111.317 -172.15 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 26.0 t -56.86 -46.97 81.44 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 168.571 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.2 -43.99 92.24 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.471 179.877 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.402 HE21 ' HE1' ' A' ' 23' ' ' TYR . 3.1 mp0 -58.17 -46.95 84.84 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 119.434 1.015 . . . . 0.0 111.114 173.378 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.91 -14.8 56.45 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 176.152 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 56.8 m-80 -122.76 10.91 9.67 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.826 1.25 . . . . 0.0 111.439 -173.693 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.9 m 55.5 41.14 31.12 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 122.56 1.171 . . . . 0.0 110.817 177.758 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.402 ' HE1' HE21 ' A' ' 19' ' ' GLN 0.255 6.5 m-85 71.85 12.86 6.15 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 128.544 2.738 . . . . 0.0 114.095 169.816 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 61.3 mtm -72.9 85.71 1.26 Allowed 'General case' 0 N--CA 1.437 -1.121 0 C-N-CA 125.323 1.449 . . . . 0.0 109.166 171.938 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -52.3 -25.66 10.1 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.214 1.006 . . . . 0.0 111.25 169.826 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.2 m -52.65 -36.7 57.24 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 127.145 2.178 . . . . 0.0 113.003 170.501 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 63.1 mttt -83.72 -40.85 18.34 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.588 0.755 . . . . 0.0 109.827 175.064 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 82.9 m -72.04 6.22 2.26 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.475 1.11 . . . . 0.0 113.341 179.433 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 67.7 mm-40 -56.29 -29.18 60.85 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 121.141 -0.974 . . . . 0.0 110.878 167.264 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.97 -55.03 37.7 Favored 'General case' 0 C--N 1.345 0.372 0 C-N-CA 125.285 1.434 . . . . 0.0 111.636 173.799 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.414 HG13 HD13 ' A' ' 14' ' ' ILE . 7.2 p -74.99 -28.75 21.33 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.677 0 C-N-CA 123.549 0.74 . . . . 0.0 109.742 -175.229 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 35.6 mt -61.55 -47.9 91.24 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 168.853 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.452 ' HA ' ' HG2' ' A' ' 36' ' ' ARG . 0.3 OUTLIER -50.76 -40.74 55.61 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 123.597 0.56 . . . . 0.0 110.328 173.456 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -68.64 -39.98 80.49 Favored 'General case' 0 N--CA 1.434 -1.27 0 C-N-CA 119.996 -0.682 . . . . 0.0 111.065 -178.943 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.508 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.3 mt -66.06 -38.94 89.59 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 117.688 -1.149 . . . . 0.0 111.058 174.7 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.496 ' HE ' ' HG2' ' A' ' 57' ' ' GLU . 3.6 ptm180 -67.72 -40.11 84.24 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 120.019 1.281 . . . . 0.0 110.112 179.155 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt -63.22 -42.32 99.24 Favored 'General case' 0 C--N 1.342 0.282 0 C-N-CA 123.131 0.572 . . . . 0.0 110.377 176.191 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 51.8 t -58.04 -51.59 69.04 Favored 'General case' 0 C--O 1.218 -0.589 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 172.298 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.7 t -57.83 -46.09 85.22 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 123.765 0.826 . . . . 0.0 112.069 -173.167 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.67 -0.51 7.02 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.438 -0.801 . . . . 0.0 113.149 -177.782 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.557 ' HB3' ' CE2' ' A' ' 42' ' ' TYR . 17.9 tt0 -83.7 -9.7 58.67 Favored 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 123.722 0.809 . . . . 0.0 111.013 175.799 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.557 ' CE2' ' HB3' ' A' ' 41' ' ' GLN . 80.8 m-85 -139.08 160.4 62.74 Favored Pre-proline 0 N--CA 1.445 -0.724 0 C-N-CA 124.766 1.226 . . . . 0.0 111.725 -167.682 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -68.05 132.47 26.33 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 N-CA-C 105.956 -2.363 . . . . 0.0 105.956 165.758 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -50.27 -42.22 51.85 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.355 1.243 . . . . 0.0 114.355 -167.026 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.78 -11.63 31.03 Favored Glycine 0 CA--C 1.531 1.051 0 CA-C-O 119.081 -0.844 . . . . 0.0 113.555 -178.87 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.61 -19.43 65.77 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 118.916 1.358 . . . . 0.0 112.361 172.471 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.9 t -145.34 136.77 25.13 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-O 122.964 1.364 . . . . 0.0 111.912 -176.929 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.7 t -69.93 -54.24 19.99 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.635 0 CA-C-N 113.697 -1.592 . . . . 0.0 108.701 -179.701 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.6 m -61.34 -38.3 79.61 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 C-N-CA 122.668 0.387 . . . . 0.0 110.232 -179.2 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 50' ' ' CYS . . . . . 0.47 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 11.2 t -66.6 -37.72 85.48 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.726 0.81 . . . . 0.0 109.751 177.354 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.5 m -64.82 -20.96 66.68 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 119.036 -0.507 . . . . 0.0 111.367 173.02 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -80.76 -23.67 59.53 Favored Glycine 0 C--N 1.345 1.031 0 CA-C-N 118.918 0.781 . . . . 0.0 112.3 169.161 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.508 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -80.88 -49.58 10.85 Favored 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 125.052 1.341 . . . . 0.0 114.04 -166.876 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -63.41 -19.6 64.82 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.549 176.105 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -76.5 -47.06 24.05 Favored 'General case' 0 C--N 1.346 0.429 0 C-N-CA 123.541 0.736 . . . . 0.0 109.947 166.525 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -53.19 -39.15 63.45 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.404 0.682 . . . . 0.0 111.041 174.111 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.496 ' HG2' ' HE ' ' A' ' 36' ' ' ARG . 34.8 mt-10 -64.43 -31.15 72.24 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 125.251 1.42 . . . . 0.0 112.114 -178.516 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -60.85 -41.52 96.0 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 169.468 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -59.2 -44.83 92.23 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 122.735 0.414 . . . . 0.0 110.284 175.211 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -62.24 -39.76 93.92 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 123.267 0.627 . . . . 0.0 110.355 179.346 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 37.2 mt -64.41 -28.48 69.71 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 117.997 -1.001 . . . . 0.0 112.318 174.191 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 30.8 p -70.05 -48.43 57.89 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 120.181 1.355 . . . . 0.0 110.184 168.745 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 33.8 mtp180 -62.99 -43.36 99.0 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 124.35 1.06 . . . . 0.0 111.482 -173.111 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -148.74 95.82 2.48 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 125.122 1.369 . . . . 0.0 107.802 170.916 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 5.0 m -64.28 136.02 56.78 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 173.835 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -173.47 177.95 2.46 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 126.525 1.93 . . . . 0.0 107.833 -175.399 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 39.6 t -70.17 43.19 0.06 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.693 1.597 . . . . 0.0 112.267 171.623 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp . . . . . 0 C--N 1.342 0.266 0 C-N-CA 125.308 1.443 . . . . 0.0 110.305 -175.106 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.5 mmt . . . . . 0 CA--C 1.538 0.515 0 CA-C-O 118.758 -0.639 . . . . 0.0 110.311 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -68.65 108.09 1.79 Allowed 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 122.585 2.19 . . . . 0.0 110.111 -176.121 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -135.09 -55.3 0.81 Allowed 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 126.927 2.091 . . . . 0.0 108.662 179.236 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -138.8 155.02 48.5 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 104.531 -2.396 . . . . 0.0 104.531 167.804 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.1 t0 -114.46 93.5 32.35 Favored Pre-proline 0 CA--C 1.536 0.418 0 C-N-CA 123.891 0.876 . . . . 0.0 109.349 -174.051 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -57.5 -32.72 94.95 Favored 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 124.09 3.193 . . . . 0.0 112.639 -175.594 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 95.3 m -94.23 -11.94 29.22 Favored 'General case' 0 N--CA 1.436 -1.15 0 C-N-CA 125.085 1.354 . . . . 0.0 113.497 -168.899 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 24.6 tp60 -62.5 -27.49 69.18 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 122.767 0.427 . . . . 0.0 110.602 178.224 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.45 -56.99 14.95 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.666 0.786 . . . . 0.0 108.92 169.579 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -64.01 -36.34 83.65 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 121.868 -0.52 . . . . 0.0 110.556 -176.722 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -60.24 -36.75 78.44 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.261 1.025 . . . . 0.0 112.472 172.619 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.6 m -65.72 -41.78 91.85 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 118.062 0.392 . . . . 0.0 111.031 169.248 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -62.61 -27.49 69.24 Favored 'General case' 0 C--O 1.226 -0.159 0 CA-C-O 117.639 -1.172 . . . . 0.0 112.159 177.907 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.413 HD13 HG13 ' A' ' 31' ' ' VAL . 46.2 mm -55.24 -52.37 46.03 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-N 120.098 1.317 . . . . 0.0 109.372 169.895 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 46.9 mm-40 -61.07 -49.75 76.1 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 -173.023 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.4 mtpm? -70.41 -37.37 74.43 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.236 1.014 . . . . 0.0 111.825 -176.015 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 12.9 t -54.27 -43.52 71.06 Favored 'General case' 0 CA--C 1.513 -0.458 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 170.134 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.94 -45.95 89.2 Favored 'General case' 0 N--CA 1.441 -0.909 0 O-C-N 123.57 0.544 . . . . 0.0 109.644 -178.075 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.426 ' HA ' ' CE1' ' A' ' 23' ' ' TYR . 4.3 mm-40 -64.38 -41.75 96.51 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 119.138 0.881 . . . . 0.0 110.604 179.291 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.39 -11.24 14.51 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 171.833 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 55.2 m-80 -127.17 10.45 6.87 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.216 1.406 . . . . 0.0 112.105 -176.567 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 5.4 m 55.1 40.93 32.03 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 122.554 1.168 . . . . 0.0 111.859 -179.904 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.426 ' CE1' ' HA ' ' A' ' 19' ' ' GLN 0.257 7.1 m-85 74.03 13.46 4.08 Favored 'General case' 0 N--CA 1.443 -0.796 0 C-N-CA 128.827 2.851 . . . . 0.0 114.371 168.464 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 67.5 mtm -70.07 84.3 0.52 Allowed 'General case' 0 N--CA 1.441 -0.909 0 C-N-CA 125.063 1.345 . . . . 0.0 109.708 170.248 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -54.26 -24.88 20.52 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.301 0.64 . . . . 0.0 111.499 172.809 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 8.4 t -56.69 -34.93 67.9 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.304 1.042 . . . . 0.0 112.42 172.656 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.9 mmtm -72.99 -46.17 53.76 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.997 0.919 . . . . 0.0 108.527 173.176 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 84.0 m -72.05 1.65 7.02 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 124.363 1.065 . . . . 0.0 113.035 -174.853 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 77.3 mm-40 -57.94 -23.85 55.34 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 120.02 1.282 . . . . 0.0 110.364 166.047 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.58 -56.55 20.76 Favored 'General case' 0 C--N 1.347 0.477 0 C-N-CA 126.043 1.737 . . . . 0.0 111.692 169.5 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.413 HG13 HD13 ' A' ' 14' ' ' ILE . 12.4 p -76.63 -26.23 16.43 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 C-N-CA 123.43 0.692 . . . . 0.0 109.932 -174.932 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.529 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 60.3 mt -61.52 -46.69 96.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 167.829 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.403 ' HA ' ' HG3' ' A' ' 36' ' ' ARG . 0.4 OUTLIER -54.84 -38.98 68.09 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 119.291 0.951 . . . . 0.0 112.285 171.062 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -67.7 -39.43 84.38 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 118.771 0.714 . . . . 0.0 110.478 178.796 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.568 HD13 ' CE1' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -66.55 -27.08 67.47 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 124.932 1.293 . . . . 0.0 109.003 175.918 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.403 ' HG3' ' HA ' ' A' ' 33' ' ' GLN . 7.9 mmt-85 -70.79 -48.79 52.39 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 176.315 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 28.1 mmtp -60.91 -31.24 70.76 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 123.575 0.547 . . . . 0.0 111.363 177.834 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 43.1 t -67.06 -58.79 4.24 Favored 'General case' 0 N--CA 1.44 -0.964 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 168.455 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 38.8 t -61.52 -39.58 91.54 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 121.115 -0.991 . . . . 0.0 113.17 -169.173 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.47 -2.02 12.62 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 -175.605 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.563 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 12.1 tt0 -94.63 -7.21 41.54 Favored 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 127.43 2.292 . . . . 0.0 111.448 -171.086 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.563 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 78.4 m-85 -138.77 161.18 59.78 Favored Pre-proline 0 N--CA 1.447 -0.602 0 C-N-CA 124.445 1.098 . . . . 0.0 112.063 -167.877 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -67.79 121.03 8.05 Favored 'Trans proline' 0 N--CA 1.456 -0.713 0 N-CA-C 104.792 -2.811 . . . . 0.0 104.792 164.436 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.9 mmtt -51.35 -33.06 27.94 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 -166.025 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.88 -14.89 32.62 Favored Glycine 0 CA--C 1.533 1.18 0 C-N-CA 124.334 0.969 . . . . 0.0 113.913 176.313 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.9 tpm_? -57.12 -31.45 65.32 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 125.32 1.448 . . . . 0.0 111.247 169.446 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.6 t -136.64 134.8 37.71 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-O 123.372 1.558 . . . . 0.0 112.62 -168.781 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 15.6 t -68.91 -54.04 22.78 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.699 0 CA-C-N 112.789 -2.005 . . . . 0.0 108.425 177.044 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 5.1 m -60.72 -43.5 95.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.47 0 CA-C-O 118.241 -0.885 . . . . 0.0 109.814 -177.969 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 43.4 t -63.11 -32.05 73.34 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.427 1.491 . . . . 0.0 110.284 179.949 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.2 m -68.81 -27.72 66.11 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.059 0.544 . . . . 0.0 111.079 172.108 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.99 -35.17 78.22 Favored Glycine 0 C--N 1.345 1.031 0 CA-C-O 123.794 1.774 . . . . 0.0 111.525 167.357 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.568 ' CE1' HD13 ' A' ' 35' ' ' LEU . 1.5 t80 -80.78 -40.34 25.27 Favored 'General case' 0 N--CA 1.415 -2.216 0 N-CA-C 117.162 2.282 . . . . 0.0 117.162 -162.687 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -68.24 -21.77 64.81 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 118.64 -0.695 . . . . 0.0 110.337 169.527 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -74.9 -37.7 62.03 Favored 'General case' 0 C--N 1.349 0.554 0 CA-C-N 119.439 1.018 . . . . 0.0 109.671 166.874 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -58.72 -34.42 71.32 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 119.051 0.841 . . . . 0.0 110.707 170.465 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -62.93 -33.79 76.08 Favored 'General case' 0 CA--C 1.532 0.27 0 O-C-N 121.728 -0.608 . . . . 0.0 111.131 178.099 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -64.35 -29.86 70.92 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.237 1.015 . . . . 0.0 111.44 173.73 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -76.18 -43.57 42.02 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 121.759 -0.588 . . . . 0.0 110.246 169.258 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -66.0 -32.18 73.52 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 121.646 -0.659 . . . . 0.0 111.451 -175.257 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.8 pp -62.76 -5.68 2.98 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 176.363 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 46.6 p -64.19 -53.1 54.58 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.7 1.136 . . . . 0.0 109.249 167.386 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 41.2 ttp180 -58.61 -32.38 68.95 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 125.531 1.532 . . . . 0.0 110.389 169.393 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 58.96 33.06 22.81 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 125.106 1.363 . . . . 0.0 111.689 171.973 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 27.3 m -165.14 172.07 13.0 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 127.403 2.281 . . . . 0.0 107.139 174.985 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . 39.13 50.19 1.81 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.161 1.385 . . . . 0.0 111.494 -173.057 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 69.8 m -127.86 28.98 5.51 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 126.052 1.741 . . . . 0.0 111.175 -171.171 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.162 0 C-N-CA 126.298 1.839 . . . . 0.0 108.193 179.421 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 mmt . . . . . 0 CA--C 1.536 0.421 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -75.63 24.93 0.41 Allowed 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 123.767 2.978 . . . . 0.0 114.334 -174.672 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -74.04 22.08 0.09 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 128.638 2.775 . . . . 0.0 113.325 -174.693 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 54.7 tptt -59.2 150.1 26.49 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.379 1.072 . . . . 0.0 110.085 177.358 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.0 t0 -123.77 93.85 46.78 Favored Pre-proline 0 N--CA 1.445 -0.723 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 168.784 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -59.04 -18.3 42.6 Favored 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 124.827 3.685 . . . . 0.0 115.053 -172.354 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 65.5 m -110.55 -8.49 14.63 Favored 'General case' 0 N--CA 1.438 -1.069 0 C-N-CA 126.888 2.075 . . . . 0.0 113.206 -168.473 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 18.5 tp60 -66.54 -23.97 66.3 Favored 'General case' 0 N--CA 1.445 -0.717 0 O-C-N 121.916 -0.49 . . . . 0.0 111.987 -173.258 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -69.07 -45.09 71.21 Favored 'General case' 0 C--O 1.225 -0.191 0 CA-C-O 121.827 0.822 . . . . 0.0 110.069 174.433 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.9 mp0 -65.74 -40.75 92.44 Favored 'General case' 0 N--CA 1.443 -0.807 0 C-N-CA 127.317 2.247 . . . . 0.0 108.098 -175.318 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.66 -44.43 73.28 Favored 'General case' 0 C--N 1.341 0.225 0 C-N-CA 125.474 1.51 . . . . 0.0 112.504 168.556 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 70.9 m -59.27 -43.87 92.47 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 110.424 -0.213 . . . . 0.0 110.424 175.399 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -63.96 -21.02 66.3 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 117.584 -1.198 . . . . 0.0 112.518 178.73 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 26.3 mm -59.75 -54.97 27.22 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.193 0 CA-C-N 120.587 1.54 . . . . 0.0 108.942 171.788 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -57.61 -54.25 49.03 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 115.163 -0.926 . . . . 0.0 108.848 178.343 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 57.2 mmtt -68.57 -30.64 69.45 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 118.567 -1.253 . . . . 0.0 111.592 -172.757 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 19.9 t -56.82 -48.85 77.05 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 168.789 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.76 -46.81 84.01 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 123.099 0.56 . . . . 0.0 110.477 179.55 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -57.22 -45.96 83.37 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.708 0.803 . . . . 0.0 111.267 174.204 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.85 -12.78 57.03 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 175.387 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -124.21 8.6 8.54 Favored 'General case' 0 C--N 1.342 0.264 0 C-N-CA 124.592 1.157 . . . . 0.0 112.29 -172.524 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 58.6 40.1 23.96 Favored 'General case' 0 C--N 1.345 0.389 0 CA-C-O 122.414 1.102 . . . . 0.0 110.846 179.42 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.264 7.1 m-85 72.09 13.88 5.77 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 127.849 2.459 . . . . 0.0 114.612 168.72 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 66.0 mtm -69.83 85.84 0.5 Allowed 'General case' 0 N--CA 1.441 -0.91 0 C-N-CA 125.063 1.345 . . . . 0.0 110.107 170.148 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -53.9 -24.47 16.24 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.505 0.722 . . . . 0.0 111.698 170.643 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.1 m -53.65 -40.56 65.97 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 126.299 1.839 . . . . 0.0 112.335 170.631 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.4 mmtm -71.85 -47.28 54.15 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 124.201 1.0 . . . . 0.0 108.754 174.132 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 70.9 m -74.22 4.29 5.93 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 124.78 1.232 . . . . 0.0 113.418 -173.626 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 59.4 mm-40 -54.9 -32.29 60.89 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 119.131 0.878 . . . . 0.0 109.894 166.846 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.96 -53.0 63.0 Favored 'General case' 0 C--N 1.345 0.39 0 C-N-CA 124.582 1.153 . . . . 0.0 111.676 174.709 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.7 p -77.54 -27.15 15.46 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.78 0 C-N-CA 123.439 0.696 . . . . 0.0 110.027 -174.296 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.529 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 53.7 mt -63.18 -44.03 99.13 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 168.581 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -57.92 -29.74 65.37 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 118.966 0.803 . . . . 0.0 111.768 173.193 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -70.17 -47.5 61.34 Favored 'General case' 0 N--CA 1.443 -0.822 0 CA-C-N 118.69 0.677 . . . . 0.0 111.557 173.458 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.471 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.7 mt -61.9 -31.6 71.91 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 118.958 0.799 . . . . 0.0 110.239 176.759 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.73 -59.72 4.96 Favored 'General case' 0 CA--C 1.52 -0.208 0 C-N-CA 125.948 1.699 . . . . 0.0 109.956 175.2 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -63.47 -34.79 78.55 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 114.715 -1.13 . . . . 0.0 110.922 -177.256 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 42.8 t -62.22 -51.64 66.97 Favored 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 169.726 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 52.5 t -64.36 -48.73 74.41 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 123.7 0.8 . . . . 0.0 112.003 -170.173 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.85 -1.3 5.28 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 124.216 1.006 . . . . 0.0 112.339 -175.707 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.488 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 2.2 tp-100 -81.32 -8.22 59.71 Favored 'General case' 0 N--CA 1.437 -1.085 0 C-N-CA 125.005 1.322 . . . . 0.0 111.288 175.033 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.488 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 82.0 m-85 -142.04 160.4 55.52 Favored Pre-proline 0 N--CA 1.443 -0.818 0 C-N-CA 125.015 1.326 . . . . 0.0 111.907 -167.438 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -69.37 124.95 11.76 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 N-CA-C 105.641 -2.484 . . . . 0.0 105.641 165.234 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -47.11 -35.75 7.5 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 116.205 1.928 . . . . 0.0 116.205 -166.947 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.9 -14.56 17.06 Favored Glycine 0 CA--C 1.534 1.265 0 C-N-CA 124.515 1.055 . . . . 0.0 114.051 177.946 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 9.0 tpm_? -54.83 -28.46 49.82 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 126.401 1.88 . . . . 0.0 112.348 168.62 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.0 t -149.69 140.37 22.61 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-O 122.623 1.202 . . . . 0.0 111.531 -168.968 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 10.5 t -69.47 -54.24 20.67 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.691 0 CA-C-N 114.019 -1.446 . . . . 0.0 108.617 178.028 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.5 m -61.07 -40.49 85.85 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 C-N-CA 122.916 0.486 . . . . 0.0 110.334 -177.542 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 50' ' ' CYS . . . . . 0.475 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 12.6 t -67.1 -36.04 81.07 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.716 1.206 . . . . 0.0 109.905 177.473 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 53.3 m -65.51 -27.59 68.58 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 121.773 -0.579 . . . . 0.0 110.873 172.476 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -71.14 -27.91 71.12 Favored Glycine 0 C--N 1.345 1.047 0 CA-C-O 122.125 0.847 . . . . 0.0 112.06 169.425 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.529 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 0.2 OUTLIER -80.95 -47.66 13.37 Favored 'General case' 0 N--CA 1.428 -1.574 0 C-N-CA 125.727 1.611 . . . . 0.0 114.801 -166.965 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -63.2 -25.48 68.36 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 119.517 -0.873 . . . . 0.0 110.152 173.626 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 10.1 mtmp? -71.03 -37.21 72.57 Favored 'General case' 0 C--N 1.347 0.465 0 CA-C-N 118.984 0.811 . . . . 0.0 110.814 167.796 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -57.94 -40.11 79.69 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 118.919 0.781 . . . . 0.0 110.107 169.139 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -66.31 -38.95 88.89 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 119.46 1.027 . . . . 0.0 111.318 175.3 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -61.36 -37.54 83.71 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.977 0.808 . . . . 0.0 110.95 170.093 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -64.72 -36.72 85.19 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 118.948 0.795 . . . . 0.0 111.689 172.416 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 60' ' ' ASN . . . . . 0.409 ' ND2' ' HE ' ' A' ' 63' ' ' ARG . 1.1 m-80 -61.38 -26.32 67.76 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 123.872 0.869 . . . . 0.0 112.269 179.814 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 85.3 mt -53.92 -27.18 29.11 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.263 0.625 . . . . 0.0 112.281 169.808 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 27.7 p -81.3 -46.77 14.25 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 124.5 1.12 . . . . 0.0 111.313 173.644 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.409 ' HE ' ' ND2' ' A' ' 60' ' ' ASN . 29.0 mtm180 -62.78 -46.98 85.5 Favored 'General case' 0 C--O 1.233 0.187 0 C-N-CA 124.886 1.274 . . . . 0.0 110.966 -176.116 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -78.09 62.48 2.85 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.661 1.584 . . . . 0.0 110.352 -175.131 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.8 m 55.98 -161.04 0.19 Allowed 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.158 0.983 . . . . 0.0 111.102 -178.098 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.75 29.45 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.669 1.587 . . . . 0.0 115.19 -177.317 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 44.4 m -72.36 26.64 0.05 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 127.216 2.206 . . . . 0.0 113.722 -178.252 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 48.8 mmtm . . . . . 0 N--CA 1.454 -0.264 0 C-N-CA 125.89 1.676 . . . . 0.0 109.954 -170.076 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.6 mtt . . . . . 0 CA--C 1.538 0.487 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -49.93 136.25 36.27 Favored 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 122.92 2.414 . . . . 0.0 111.227 171.381 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -71.57 40.73 0.07 Allowed 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 127.473 2.309 . . . . 0.0 113.082 -174.928 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 35.3 mmtp -61.67 126.8 28.63 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 106.761 -1.57 . . . . 0.0 106.761 169.021 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -91.9 100.27 3.3 Favored Pre-proline 0 CA--C 1.537 0.464 0 C-N-CA 124.106 0.962 . . . . 0.0 109.125 -168.862 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_exo -60.57 -31.34 92.18 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 123.599 2.866 . . . . 0.0 112.781 -171.809 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.414 ' HB3' ' CD2' ' A' ' 35' ' ' LEU . 77.7 m -94.25 -13.17 26.82 Favored 'General case' 0 N--CA 1.438 -1.069 0 C-N-CA 125.194 1.398 . . . . 0.0 112.558 -169.45 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.0 tp60 -61.7 -25.23 67.29 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 123.131 0.572 . . . . 0.0 110.855 177.804 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.8 tttm -60.14 -56.58 19.83 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.824 1.25 . . . . 0.0 109.962 168.118 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -62.99 -36.97 85.3 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.355 0.662 . . . . 0.0 110.568 -177.992 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.63 -43.95 72.75 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 124.854 1.262 . . . . 0.0 112.214 169.388 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 80.8 m -57.93 -43.5 86.32 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 121.174 -0.21 . . . . 0.0 110.965 172.96 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -63.61 -23.56 67.43 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-O 117.751 -1.119 . . . . 0.0 112.491 178.728 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 26.4 mm -59.36 -54.72 30.39 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.226 0 CA-C-N 120.128 1.331 . . . . 0.0 108.833 172.531 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 33.0 mm-40 -59.2 -53.07 62.49 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.422 179.467 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.34 -33.08 74.93 Favored 'General case' 0 C--N 1.333 -0.111 0 C-N-CA 118.703 -1.199 . . . . 0.0 111.568 -175.811 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 23.6 t -56.1 -47.68 77.59 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 119.271 0.941 . . . . 0.0 108.944 169.329 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.07 -46.83 84.78 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 123.516 0.727 . . . . 0.0 110.682 178.8 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -57.4 -43.83 84.05 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.72 0.808 . . . . 0.0 111.305 173.782 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.5 -11.96 59.19 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.076 0.95 . . . . 0.0 113.477 174.631 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 -125.66 8.63 7.62 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 124.719 1.208 . . . . 0.0 112.358 -172.029 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.1 m 58.56 40.17 24.0 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-N 119.494 1.043 . . . . 0.0 110.903 179.78 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.257 6.9 m-85 71.71 13.34 6.24 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 127.654 2.382 . . . . 0.0 114.779 168.614 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 64.4 mtm -70.17 84.61 0.54 Allowed 'General case' 0 N--CA 1.441 -0.892 0 C-N-CA 125.184 1.394 . . . . 0.0 109.722 170.082 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -54.63 -24.27 20.78 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 119.063 -0.494 . . . . 0.0 111.637 172.335 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.8 m -51.77 -44.05 63.22 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 126.452 1.901 . . . . 0.0 112.141 170.076 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.4 mmtm -67.75 -48.49 66.26 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 124.175 0.99 . . . . 0.0 108.687 174.651 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.422 ' O ' HG12 ' A' ' 31' ' ' VAL . 73.2 m -72.73 2.71 6.1 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 124.973 1.309 . . . . 0.0 113.302 -174.748 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 45.9 mm-40 -56.3 -26.64 52.82 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 120.078 1.308 . . . . 0.0 111.281 168.159 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.34 -51.38 69.64 Favored 'General case' 0 C--N 1.345 0.392 0 C-N-CA 125.537 1.535 . . . . 0.0 112.184 169.951 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.422 HG12 ' O ' ' A' ' 28' ' ' CYS . 9.7 p -80.71 -26.09 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.888 0 C-N-CA 123.698 0.799 . . . . 0.0 109.657 -174.759 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.5 mp -60.51 -48.52 88.15 Favored 'Isoleucine or valine' 0 C--N 1.35 0.593 0 N-CA-C 105.689 -1.967 . . . . 0.0 105.689 166.214 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.454 ' HA ' ' HG2' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -52.98 -37.63 61.48 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 123.212 0.605 . . . . 0.0 110.886 176.514 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -70.91 -39.49 72.69 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 120.072 -0.651 . . . . 0.0 110.974 179.669 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.549 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.0 OUTLIER -64.4 -36.83 85.41 Favored 'General case' 0 C--N 1.342 0.279 0 CA-C-O 117.877 -1.059 . . . . 0.0 110.765 174.663 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.473 ' HE ' ' HG2' ' A' ' 57' ' ' GLU . 0.0 OUTLIER -68.12 -40.5 82.51 Favored 'General case' 0 C--N 1.341 0.219 0 CA-C-N 119.775 1.17 . . . . 0.0 110.215 178.347 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 57.2 mttp -63.49 -39.55 94.73 Favored 'General case' 0 C--N 1.341 0.218 0 CA-C-O 119.232 -0.413 . . . . 0.0 111.012 175.536 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.1 t -59.33 -52.74 64.34 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 171.937 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.1 t -57.74 -48.87 78.4 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 124.034 0.934 . . . . 0.0 112.048 -171.663 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.12 -1.25 7.26 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.241 -0.89 . . . . 0.0 112.722 -175.148 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.539 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 21.2 tt0 -84.15 -12.09 55.52 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 125.203 1.401 . . . . 0.0 111.345 179.088 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.539 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 76.4 m-85 -133.02 157.87 77.26 Favored Pre-proline 0 N--CA 1.447 -0.617 0 C-N-CA 124.174 0.99 . . . . 0.0 112.003 -168.146 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -67.31 109.43 1.78 Allowed 'Trans proline' 0 N--CA 1.453 -0.898 0 N-CA-C 104.878 -2.778 . . . . 0.0 104.878 165.501 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.88 -27.48 0.53 Allowed 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 117.199 2.296 . . . . 0.0 117.199 -166.773 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.47 -18.44 29.92 Favored Glycine 0 CA--C 1.536 1.369 0 CA-C-N 119.512 1.051 . . . . 0.0 113.571 172.479 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.26 -21.19 63.67 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.946 2.098 . . . . 0.0 112.516 170.93 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.6 t -148.06 134.59 19.75 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 123.566 1.651 . . . . 0.0 114.152 -170.434 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.8 t -72.43 -55.33 13.52 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.638 0 CA-C-N 112.552 -2.113 . . . . 0.0 108.886 178.017 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 5.9 m -59.2 -40.88 82.21 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 C-N-CA 122.684 0.394 . . . . 0.0 110.029 -179.178 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 50' ' ' CYS . . . . . 0.452 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 13.3 t -63.78 -37.57 87.88 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.524 1.13 . . . . 0.0 109.713 178.021 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 52.7 m -67.64 -17.11 64.49 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 118.727 -0.654 . . . . 0.0 112.319 175.035 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -86.04 -20.57 55.1 Favored Glycine 0 C--N 1.344 0.991 0 CA-C-N 119.148 0.886 . . . . 0.0 112.205 167.776 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.549 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -80.21 -43.13 22.0 Favored 'General case' 0 N--CA 1.418 -2.052 0 N-CA-C 113.959 1.096 . . . . 0.0 113.959 -166.269 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -62.27 -17.72 59.31 Favored 'General case' 0 C--N 1.319 -0.752 0 O-C-N 123.975 0.797 . . . . 0.0 110.68 179.916 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 57.8 mttm -71.39 -52.94 15.86 Favored 'General case' 0 C--N 1.345 0.408 0 CA-C-N 118.654 0.661 . . . . 0.0 109.466 167.244 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -62.17 -25.73 67.93 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.013 1.325 . . . . 0.0 112.552 176.526 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.473 ' HG2' ' HE ' ' A' ' 36' ' ' ARG . 15.8 mt-10 -63.69 -35.18 79.71 Favored 'General case' 0 N--CA 1.455 -0.183 0 O-C-N 121.025 -1.047 . . . . 0.0 110.913 173.599 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.8 mm-40 -62.89 -45.7 91.29 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 172.025 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.6 tp10 -58.69 -36.4 74.15 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 112.411 0.522 . . . . 0.0 112.411 175.505 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -72.79 -54.26 9.33 Favored 'General case' 0 N--CA 1.453 -0.28 0 O-C-N 121.468 -0.77 . . . . 0.0 111.164 175.88 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.2 pp -65.97 -32.37 73.82 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 118.796 0.725 . . . . 0.0 111.028 -171.712 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -64.59 -43.14 94.79 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.439 0.563 . . . . 0.0 109.709 172.633 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 75.9 mtm180 -66.25 -35.03 79.36 Favored 'General case' 0 CA--C 1.534 0.331 0 O-C-N 121.245 -0.909 . . . . 0.0 111.051 176.1 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.33 18.0 0.75 Allowed 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.043 1.737 . . . . 0.0 113.866 178.024 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 89.1 p -159.55 -170.12 2.82 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.301 1.441 . . . . 0.0 110.462 -176.557 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.12 87.95 0.16 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.404 1.082 . . . . 0.0 108.643 169.699 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 9.6 m -52.05 102.33 0.05 OUTLIER 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 126.652 1.981 . . . . 0.0 115.604 -168.115 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 43.7 mmtm . . . . . 0 N--CA 1.448 -0.526 0 C-N-CA 125.05 1.34 . . . . 0.0 107.665 167.624 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 73.4 mtm . . . . . 0 CA--C 1.539 0.549 0 CA-C-O 118.658 -0.687 . . . . 0.0 109.583 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -67.61 104.12 0.91 Allowed 'Trans proline' 0 C--N 1.35 0.652 0 C-N-CA 124.099 3.2 . . . . 0.0 111.769 -171.584 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 12.3 mt-30 -145.84 171.99 13.98 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 128.759 2.823 . . . . 0.0 107.444 -176.236 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -63.31 105.7 0.78 Allowed 'General case' 0 C--N 1.341 0.215 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 168.327 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -93.73 99.53 3.61 Favored Pre-proline 0 CA--C 1.539 0.524 0 C-N-CA 125.189 1.396 . . . . 0.0 111.814 -166.33 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -63.85 -28.42 67.51 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 123.646 2.897 . . . . 0.0 112.671 -175.509 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 13.1 m -91.44 -8.1 48.75 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 123.418 0.687 . . . . 0.0 112.145 -176.927 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 20.1 tp60 -63.48 -25.04 68.08 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 119.13 0.877 . . . . 0.0 110.527 -179.514 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -60.04 -52.32 65.89 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.506 1.122 . . . . 0.0 109.589 169.454 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -65.37 -38.71 90.89 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.616 -0.678 . . . . 0.0 110.244 -179.442 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -59.97 -35.4 74.92 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.136 0.974 . . . . 0.0 112.522 172.329 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 95.6 m -65.13 -43.55 91.55 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.229 0.468 . . . . 0.0 110.936 169.207 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 -62.75 -25.54 68.25 Favored 'General case' 0 C--O 1.225 -0.232 0 CA-C-O 117.725 -1.131 . . . . 0.0 112.221 178.367 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 45.2 mm -56.72 -50.3 74.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-N 120.187 1.358 . . . . 0.0 109.439 169.56 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 44.9 mm-40 -60.68 -54.32 46.74 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 -175.729 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 27.0 mttm -70.53 -30.92 67.8 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 118.56 -0.733 . . . . 0.0 111.623 -173.29 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 21.5 t -56.98 -46.0 82.52 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 107.934 -1.136 . . . . 0.0 107.934 168.666 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.0 -43.9 91.58 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-O 118.297 -0.859 . . . . 0.0 110.372 179.722 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -58.51 -46.51 86.6 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 119.475 1.034 . . . . 0.0 111.129 173.07 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.42 -15.28 60.3 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 175.953 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.3 m-80 -122.81 11.05 9.65 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.925 1.29 . . . . 0.0 111.43 -172.931 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.9 m 55.98 40.74 30.36 Favored 'General case' 0 C--N 1.346 0.44 0 CA-C-O 122.556 1.17 . . . . 0.0 110.817 177.315 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.253 6.7 m-85 71.85 12.59 6.17 Favored 'General case' 0 N--CA 1.444 -0.758 0 C-N-CA 128.466 2.706 . . . . 0.0 114.068 169.713 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 62.0 mtm -73.26 83.99 1.38 Allowed 'General case' 0 N--CA 1.437 -1.123 0 C-N-CA 125.445 1.498 . . . . 0.0 109.159 172.214 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -53.46 -24.01 11.68 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.022 0.929 . . . . 0.0 111.465 172.115 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.1 m -51.88 -41.29 61.78 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 126.131 1.773 . . . . 0.0 112.307 169.988 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 56.8 mttt -76.69 -42.5 41.35 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.234 0.614 . . . . 0.0 109.753 175.779 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.8 m -70.98 0.73 6.79 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 124.193 0.997 . . . . 0.0 113.275 -178.7 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 82.3 mm-40 -55.25 -27.44 46.44 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 119.935 1.243 . . . . 0.0 110.823 167.114 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.07 -60.57 3.54 Favored 'General case' 0 C--N 1.345 0.401 0 C-N-CA 125.637 1.575 . . . . 0.0 111.467 171.46 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.6 p -70.93 -29.46 37.38 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.694 0 C-N-CA 123.635 0.774 . . . . 0.0 109.979 -174.437 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.518 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 70.3 mt -58.63 -52.7 56.66 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 N-CA-C 105.869 -1.9 . . . . 0.0 105.869 168.842 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -58.79 -30.07 67.3 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 119.48 1.036 . . . . 0.0 113.187 175.921 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -71.27 -37.67 71.89 Favored 'General case' 0 N--CA 1.438 -1.072 0 C-N-CA 119.833 -0.747 . . . . 0.0 109.724 176.62 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.517 HD13 ' CE1' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -63.42 -30.74 71.82 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 124.811 1.244 . . . . 0.0 108.916 172.289 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.2 mmt85 -70.35 -49.58 47.84 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 -179.952 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 46.1 mttp -61.71 -36.57 81.29 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 124.257 1.023 . . . . 0.0 111.156 177.13 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 42.7 t -60.45 -54.04 50.27 Favored 'General case' 0 C--O 1.221 -0.429 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 169.357 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 51.5 t -61.49 -44.27 97.39 Favored 'General case' 0 CA--C 1.515 -0.379 0 C-N-CA 124.477 1.111 . . . . 0.0 112.202 -169.6 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.45 -3.14 16.31 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.18 -0.918 . . . . 0.0 113.112 -178.354 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.444 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 2.5 tp-100 -88.63 -2.48 58.62 Favored 'General case' 0 N--CA 1.439 -0.999 0 C-N-CA 124.219 1.008 . . . . 0.0 111.361 -175.783 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.444 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 63.2 m-85 -143.13 162.88 40.83 Favored Pre-proline 0 N--CA 1.443 -0.804 0 C-N-CA 127.364 2.266 . . . . 0.0 110.795 -168.882 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_exo -61.33 116.97 3.74 Favored 'Trans proline' 0 N--CA 1.456 -0.699 0 N-CA-C 105.706 -2.459 . . . . 0.0 105.706 166.231 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -51.84 -35.36 44.31 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 120.498 1.499 . . . . 0.0 114.655 -168.929 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -70.26 -4.61 51.13 Favored Glycine 0 CA--C 1.531 1.089 0 CA-C-O 118.258 -1.301 . . . . 0.0 114.143 178.395 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.97 -7.18 32.78 Favored 'General case' 0 CA--C 1.554 1.104 0 CA-C-N 120.044 1.922 . . . . 0.0 111.86 174.508 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.7 t -141.17 155.32 46.09 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 126.162 1.785 . . . . 0.0 110.404 -168.392 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 47.9 t -79.2 -60.92 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.562 0 C-N-CA 124.876 1.27 . . . . 0.0 108.801 171.197 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.5 m -60.37 -44.31 95.71 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 CA-C-O 119.073 -0.489 . . . . 0.0 110.044 -169.631 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 31.7 t -65.64 -29.39 69.96 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.177 1.391 . . . . 0.0 110.23 -179.737 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 69.6 m -69.68 -21.62 63.5 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 118.533 -0.746 . . . . 0.0 111.307 171.796 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -75.51 -39.23 35.82 Favored Glycine 0 C--N 1.344 1.009 0 CA-C-O 124.474 2.152 . . . . 0.0 110.681 166.976 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.518 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 1.1 t80 -76.69 -38.73 53.94 Favored 'General case' 0 N--CA 1.419 -1.998 0 CA-C-N 111.819 -2.19 . . . . 0.0 116.705 -163.721 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -65.4 -20.09 66.23 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 118.643 -0.694 . . . . 0.0 110.954 169.731 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 42.4 mmtm -72.88 -40.12 65.88 Favored 'General case' 0 C--N 1.347 0.491 0 CA-C-N 119.627 1.103 . . . . 0.0 109.32 167.677 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -55.36 -46.01 76.48 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 118.414 0.552 . . . . 0.0 110.161 170.757 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -60.76 -39.6 89.34 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-O 118.691 -0.671 . . . . 0.0 110.433 176.583 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -60.08 -36.22 76.89 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 119.204 0.911 . . . . 0.0 111.125 175.986 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -63.99 -48.98 74.28 Favored 'General case' 0 C--N 1.343 0.289 0 CA-C-N 118.659 0.663 . . . . 0.0 110.285 169.983 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -64.87 -29.13 70.06 Favored 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 123.756 0.822 . . . . 0.0 111.764 -173.943 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 58.1 mt -61.19 -17.51 53.46 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.832 0.853 . . . . 0.0 112.989 172.895 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 44.1 p -72.17 -49.0 39.21 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 120.05 1.296 . . . . 0.0 110.204 169.886 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 7.7 tmm_? -64.1 -31.07 72.13 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 127.231 2.212 . . . . 0.0 111.463 175.758 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . 0.284 17.9 pttm 48.48 -158.46 0.06 Allowed 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 128.277 2.631 . . . . 0.0 112.534 174.257 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.7 m 66.0 -166.59 0.22 Allowed 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 -167.125 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.64 138.83 57.61 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.774 -0.579 . . . . 0.0 112.052 -176.323 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -167.79 172.1 9.43 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 127.001 2.121 . . . . 0.0 106.686 168.599 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 20.7 ttmm . . . . . 0 N--CA 1.466 0.366 0 C-N-CA 125.572 1.549 . . . . 0.0 111.997 170.746 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 36.0 t0 . . . . . 0 N--CA 1.446 -0.647 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -55.91 -33.93 90.28 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 124.499 3.466 . . . . 0.0 113.068 -175.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.408 ' HB3' ' CD2' ' A' ' 35' ' ' LEU . 56.8 m -94.92 -13.2 25.61 Favored 'General case' 0 N--CA 1.435 -1.217 0 C-N-CA 125.815 1.646 . . . . 0.0 113.054 -169.165 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.6 tp60 -62.64 -25.94 68.37 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.695 0.68 . . . . 0.0 111.416 -177.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -61.21 -50.44 73.07 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.376 0.67 . . . . 0.0 110.195 172.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -64.47 -44.59 90.56 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 123.777 0.831 . . . . 0.0 109.149 179.268 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.59 -41.53 54.74 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 119.937 1.244 . . . . 0.0 113.035 174.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 84.6 m -56.56 -46.7 80.58 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 123.419 0.449 . . . . 0.0 110.128 174.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -60.28 -39.04 85.48 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 117.496 -1.24 . . . . 0.0 112.303 177.116 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 2.0 mp -59.16 -49.87 81.82 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 CA-C-N 120.451 1.478 . . . . 0.0 109.482 173.281 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 93.8 mm-40 -61.34 -51.35 69.18 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 -174.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 41.2 mtpt -68.89 -37.98 79.34 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 123.798 0.839 . . . . 0.0 111.945 -177.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 17.2 t -52.28 -46.45 65.87 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 169.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.57 -46.39 84.02 Favored 'General case' 0 N--CA 1.442 -0.856 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 -177.075 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.435 ' HA ' ' CE1' ' A' ' 23' ' ' TYR . 3.1 mm-40 -63.15 -44.2 96.2 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 118.999 0.818 . . . . 0.0 110.637 179.265 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -60.95 -14.11 20.49 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 113.193 0.812 . . . . 0.0 113.193 172.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 57.9 m-80 -122.34 11.51 10.04 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.59 1.556 . . . . 0.0 111.123 -177.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 12.6 m 51.6 43.31 29.86 Favored 'General case' 0 C--N 1.346 0.447 0 C-N-CA 125.026 1.33 . . . . 0.0 112.011 -179.256 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.435 ' CE1' ' HA ' ' A' ' 19' ' ' GLN 0.271 7.4 m-85 73.49 14.26 4.38 Favored 'General case' 0 N--CA 1.441 -0.891 0 C-N-CA 129.14 2.976 . . . . 0.0 113.976 169.145 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 64.7 mtm -69.88 85.03 0.49 Allowed 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 125.37 1.468 . . . . 0.0 110.351 170.057 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -55.33 -17.6 5.04 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 127.115 2.166 . . . . 0.0 111.179 168.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 68.8 m -60.75 -54.06 49.86 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.76 1.624 . . . . 0.0 110.346 168.136 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 57.6 mttt -67.3 -43.29 82.07 Favored 'General case' 0 C--O 1.231 0.128 0 O-C-N 121.799 -0.563 . . . . 0.0 109.846 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.5 m -71.09 2.69 4.19 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 117.234 -1.365 . . . . 0.0 113.164 175.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 59.0 mm-40 -53.6 -34.24 57.73 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 121.022 1.737 . . . . 0.0 111.432 169.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.08 -56.42 22.49 Favored 'General case' 0 C--N 1.342 0.271 0 CA-C-N 119.271 0.941 . . . . 0.0 111.308 177.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.9 p -73.21 -33.22 40.99 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.025 -174.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 35.9 mt -59.25 -44.05 91.18 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.467 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 170.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.54 -34.71 62.24 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 118.332 0.515 . . . . 0.0 111.172 173.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -72.09 -40.17 68.41 Favored 'General case' 0 N--CA 1.427 -1.581 0 C-N-CA 118.536 -1.266 . . . . 0.0 111.158 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.492 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.5 mt -65.01 -30.5 71.49 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 119.903 1.229 . . . . 0.0 111.75 173.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.95 -58.23 9.46 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 124.053 0.941 . . . . 0.0 108.879 174.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.48 -35.62 76.34 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 114.15 -1.386 . . . . 0.0 111.11 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 49.6 t -62.27 -50.11 72.99 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 123.52 0.728 . . . . 0.0 109.288 172.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 53.1 t -64.05 -48.07 77.72 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 123.905 0.882 . . . . 0.0 111.671 -172.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.408 ' HA ' ' HE3' ' A' ' 44' ' ' LYS . . . -67.45 -2.98 7.21 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 124.434 1.093 . . . . 0.0 112.706 -178.167 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.444 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 2.6 tp-100 -83.5 -5.87 59.29 Favored 'General case' 0 N--CA 1.439 -1.015 0 C-N-CA 124.87 1.268 . . . . 0.0 111.414 179.096 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.444 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 82.6 m-85 -138.81 161.83 56.15 Favored Pre-proline 0 N--CA 1.444 -0.767 0 C-N-CA 125.415 1.486 . . . . 0.0 110.508 -169.045 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -67.73 107.95 1.56 Allowed 'Trans proline' 0 N--CA 1.457 -0.664 0 N-CA-C 104.518 -2.916 . . . . 0.0 104.518 165.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.408 ' HE3' ' HA ' ' A' ' 40' ' ' ALA . 31.6 mmtm -38.08 -43.29 0.73 Allowed 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 117.04 2.237 . . . . 0.0 117.04 -163.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.19 -14.33 11.54 Favored Glycine 0 CA--C 1.537 1.429 0 C-N-CA 124.475 1.036 . . . . 0.0 114.109 177.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 29.1 tpt85 -48.83 -34.11 11.81 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 128.285 2.634 . . . . 0.0 112.168 170.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.3 t -138.78 140.86 38.76 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-O 121.939 0.876 . . . . 0.0 110.301 -169.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 11.8 t -69.52 -53.29 25.52 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 CA-C-N 114.413 -1.267 . . . . 0.0 108.823 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 5.0 m -61.88 -38.9 81.71 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 CA-C-O 119.297 -0.382 . . . . 0.0 110.248 -178.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . 0.474 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 10.2 t -66.27 -38.31 87.51 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.915 0.886 . . . . 0.0 109.799 176.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.4 m -65.24 -21.07 66.69 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 118.803 -0.618 . . . . 0.0 111.309 173.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -79.01 -25.97 58.95 Favored Glycine 0 C--N 1.343 0.958 0 CA-C-O 122.173 0.874 . . . . 0.0 112.34 168.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.492 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -80.41 -44.85 18.65 Favored 'General case' 0 N--CA 1.429 -1.503 0 N-CA-C 114.85 1.426 . . . . 0.0 114.85 -165.642 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 . . . . . 0 C--N 1.319 -0.744 0 O-C-N 123.546 0.528 . . . . 0.0 110.425 173.865 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 27.2 t0 . . . . . 0 N--CA 1.444 -0.744 0 CA-C-O 118.127 -0.94 . . . . 0.0 109.245 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -55.94 -29.44 73.23 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 123.68 2.92 . . . . 0.0 113.572 -176.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 99.1 m -102.27 -8.78 20.97 Favored 'General case' 0 N--CA 1.438 -1.057 0 C-N-CA 125.857 1.663 . . . . 0.0 113.974 -168.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.1 tt0 -62.96 -26.0 68.63 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 123.454 0.702 . . . . 0.0 111.327 -179.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.9 tmtt? -61.34 -53.23 59.34 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.45 1.1 . . . . 0.0 109.977 169.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -63.61 -43.96 95.38 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.714 0.806 . . . . 0.0 109.866 -178.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -51.05 -42.03 60.26 Favored 'General case' 0 C--N 1.341 0.217 0 C-N-CA 125.227 1.411 . . . . 0.0 112.773 169.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 79.7 m -63.23 -43.53 97.82 Favored 'General case' 0 C--O 1.234 0.239 0 O-C-N 123.166 0.291 . . . . 0.0 111.114 174.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 57.1 mm-40 -59.52 -32.93 70.75 Favored 'General case' 0 C--N 1.342 0.28 0 CA-C-O 118.325 -0.845 . . . . 0.0 111.529 177.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.626 HD13 HG22 ' A' ' 31' ' ' VAL . 10.6 mm -58.42 -44.63 89.12 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.143 0 CA-C-N 119.519 1.054 . . . . 0.0 110.561 174.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 63.8 mm-40 -64.68 -51.13 64.11 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 -169.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.0 tmtt? -67.52 -39.54 85.1 Favored 'General case' 0 N--CA 1.442 -0.862 0 C-N-CA 127.536 2.334 . . . . 0.0 111.407 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 15.3 t -52.37 -44.97 65.58 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 170.151 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.8 -44.88 93.74 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-O 118.826 -0.607 . . . . 0.0 109.951 -178.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.416 ' HA ' ' CE1' ' A' ' 23' ' ' TYR . 4.9 mm-40 -65.44 -41.34 93.58 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 119.243 0.928 . . . . 0.0 110.65 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.75 -11.87 14.21 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.069 0.948 . . . . 0.0 113.102 171.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 57.8 m-80 -125.35 10.09 7.95 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.085 1.354 . . . . 0.0 112.142 -176.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 13.1 m 53.43 42.36 32.0 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-O 122.723 1.249 . . . . 0.0 112.003 -178.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.416 ' CE1' ' HA ' ' A' ' 19' ' ' GLN 0.259 6.5 m-85 73.34 13.26 4.66 Favored 'General case' 0 N--CA 1.444 -0.749 0 C-N-CA 128.431 2.692 . . . . 0.0 114.486 168.504 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 68.7 mtm -69.86 84.8 0.49 Allowed 'General case' 0 N--CA 1.441 -0.922 0 C-N-CA 124.876 1.27 . . . . 0.0 109.725 169.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -53.34 -25.1 13.83 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.828 0.851 . . . . 0.0 111.337 170.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.5 m -51.16 -40.47 58.67 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 126.631 1.972 . . . . 0.0 112.587 170.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 54.2 mmtt -74.52 -47.9 30.24 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.358 1.063 . . . . 0.0 108.8 175.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 82.3 m -71.65 3.21 4.22 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.905 1.282 . . . . 0.0 113.224 -176.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 41.3 mm-40 -54.8 -32.9 60.81 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 119.488 1.04 . . . . 0.0 110.151 167.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.99 -58.89 6.17 Favored 'General case' 0 C--N 1.345 0.408 0 C-N-CA 124.977 1.311 . . . . 0.0 111.333 175.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.626 HG22 HD13 ' A' ' 14' ' ' ILE . 10.6 p -69.85 -32.27 51.27 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 C-N-CA 124.013 0.925 . . . . 0.0 109.761 -174.206 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.416 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 72.4 mt -60.42 -48.28 89.02 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 N-CA-C 107.106 -1.442 . . . . 0.0 107.106 170.156 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.421 ' HA ' ' HG3' ' A' ' 36' ' ' ARG . 1.6 tp-100 -59.26 -20.39 53.84 Favored 'General case' 0 N--CA 1.439 -0.976 0 O-C-N 121.08 -1.013 . . . . 0.0 112.692 175.589 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.3 tp10 -80.36 -34.93 36.13 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 120.366 1.439 . . . . 0.0 111.83 169.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.477 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.9 mt -58.82 -27.13 64.8 Favored 'General case' 0 C--N 1.345 0.399 0 CA-C-N 120.298 1.408 . . . . 0.0 109.456 172.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.421 ' HG3' ' HA ' ' A' ' 33' ' ' GLN . 18.3 mmt85 -64.17 -52.22 60.02 Favored 'General case' 0 CA--C 1.52 -0.206 0 C-N-CA 123.915 0.886 . . . . 0.0 109.487 176.362 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -67.99 -28.09 67.13 Favored 'General case' 0 C--O 1.235 0.304 0 O-C-N 123.572 0.545 . . . . 0.0 111.036 -177.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 49.8 t -68.11 -53.0 28.59 Favored 'General case' 0 N--CA 1.438 -1.041 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 168.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 51.8 t -64.12 -50.53 67.9 Favored 'General case' 0 CA--C 1.515 -0.389 0 C-N-CA 124.33 1.052 . . . . 0.0 112.381 -169.332 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.93 0.95 3.81 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.708 0.803 . . . . 0.0 112.613 -173.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.564 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 9.5 tt0 -82.82 -11.17 58.45 Favored 'General case' 0 N--CA 1.439 -1.008 0 C-N-CA 126.721 2.008 . . . . 0.0 110.855 176.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.564 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 77.1 m-85 -139.92 162.02 52.79 Favored Pre-proline 0 N--CA 1.445 -0.677 0 C-N-CA 125.125 1.37 . . . . 0.0 111.877 -168.093 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.43 144.77 46.22 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 N-CA-C 107.692 -1.696 . . . . 0.0 107.692 166.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 55.3 tttp -52.23 -40.73 62.02 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 114.189 1.181 . . . . 0.0 114.189 -170.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -64.92 -7.63 30.81 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 124.016 0.817 . . . . 0.0 113.604 -179.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.3 tpm_? -70.33 -21.16 62.94 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 118.957 1.379 . . . . 0.0 111.61 172.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.8 t -150.69 135.18 17.17 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-O 122.982 1.372 . . . . 0.0 112.867 -169.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 13.4 t -67.43 -52.57 40.4 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 CA-C-N 113.39 -1.732 . . . . 0.0 108.449 175.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 3.1 m -64.28 -41.82 93.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 CA-C-O 118.321 -0.847 . . . . 0.0 109.923 -176.412 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . 0.42 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 43.9 t -64.53 -30.51 71.53 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.708 1.603 . . . . 0.0 110.019 177.219 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 48.9 m -67.01 -32.37 73.56 Favored 'General case' 0 CA--C 1.536 0.41 0 O-C-N 121.682 -0.636 . . . . 0.0 110.903 170.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.51 -33.36 84.44 Favored Glycine 0 C--N 1.344 0.985 0 CA-C-O 123.033 1.352 . . . . 0.0 111.397 168.193 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.477 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.7 OUTLIER -81.03 -45.35 16.69 Favored 'General case' 0 N--CA 1.423 -1.812 0 N-CA-C 115.785 1.772 . . . . 0.0 115.785 -165.695 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 . . . . . 0 CA--C 1.541 0.634 0 CA-C-O 119.121 -0.466 . . . . 0.0 110.219 169.911 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 41.9 t0 . . . . . 0 N--CA 1.449 -0.497 0 CA-C-O 118.33 -0.843 . . . . 0.0 108.895 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -56.68 -35.75 97.75 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 123.626 2.884 . . . . 0.0 112.211 -173.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 95.0 m -92.89 -7.96 44.7 Favored 'General case' 0 N--CA 1.442 -0.843 0 C-N-CA 126.246 1.818 . . . . 0.0 113.49 -168.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.6 tp60 -61.66 -24.78 66.96 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 117.966 0.348 . . . . 0.0 110.592 179.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 61.1 tttm -56.98 -60.01 4.21 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 125.209 1.404 . . . . 0.0 109.758 167.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 19.8 mp0 -57.81 -45.6 85.86 Favored 'General case' 0 C--O 1.225 -0.204 0 C-N-CA 123.88 0.872 . . . . 0.0 110.206 -176.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -52.54 -41.82 63.84 Favored 'General case' 0 C--N 1.338 0.096 0 C-N-CA 125.055 1.342 . . . . 0.0 112.697 173.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 92.4 m -61.69 -47.51 84.98 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 117.706 0.23 . . . . 0.0 110.609 172.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -62.21 -24.51 67.26 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-O 117.8 -1.095 . . . . 0.0 112.262 -179.102 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 35.8 mm -56.05 -53.4 39.12 Favored 'Isoleucine or valine' 0 C--N 1.343 0.29 0 CA-C-N 120.126 1.33 . . . . 0.0 109.624 172.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -58.73 -54.35 48.03 Favored 'General case' 0 N--CA 1.445 -0.68 0 O-C-N 124.025 0.828 . . . . 0.0 109.196 -179.484 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -66.7 -31.98 73.0 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 119.132 -1.027 . . . . 0.0 111.675 -174.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 20.4 t -56.48 -48.74 76.48 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 119.362 0.983 . . . . 0.0 108.681 169.23 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.05 -46.88 84.65 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 123.178 0.591 . . . . 0.0 110.429 179.461 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -56.98 -46.28 82.35 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.663 0.785 . . . . 0.0 111.258 174.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.59 -12.74 55.82 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.127 0.971 . . . . 0.0 113.475 175.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.3 m-80 -123.87 8.65 8.75 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.65 1.18 . . . . 0.0 112.149 -173.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 58.23 40.27 24.94 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 122.376 1.084 . . . . 0.0 110.873 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.262 7.1 m-85 71.97 14.08 5.87 Favored 'General case' 0 N--CA 1.444 -0.764 0 C-N-CA 127.876 2.47 . . . . 0.0 114.66 168.8 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 65.8 mtm -69.62 86.26 0.47 Allowed 'General case' 0 N--CA 1.443 -0.823 0 C-N-CA 125.147 1.379 . . . . 0.0 109.982 169.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -53.37 -25.87 17.14 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.414 0.686 . . . . 0.0 111.4 169.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.9 m -53.4 -38.66 63.63 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.834 2.054 . . . . 0.0 112.709 171.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.6 mmtm -73.98 -47.95 33.69 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 124.224 1.01 . . . . 0.0 108.58 173.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.2 m -73.09 2.7 6.6 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 124.753 1.221 . . . . 0.0 113.567 -173.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 27.1 mm-40 -54.49 -28.44 44.82 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 119.604 1.093 . . . . 0.0 110.08 167.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.73 -58.44 8.57 Favored 'General case' 0 C--N 1.348 0.504 0 C-N-CA 126.087 1.755 . . . . 0.0 111.955 172.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.6 p -72.59 -30.28 33.4 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 C-N-CA 123.873 0.869 . . . . 0.0 110.074 -174.002 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.512 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 75.9 mt -59.18 -48.76 85.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 N-CA-C 106.229 -1.767 . . . . 0.0 106.229 168.675 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.1 -25.8 59.38 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 121.014 -1.054 . . . . 0.0 113.454 174.048 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 49.6 tt0 -75.08 -39.78 60.55 Favored 'General case' 0 N--CA 1.434 -1.249 0 C-N-CA 119.353 -0.939 . . . . 0.0 110.486 174.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.463 ' HB3' ' CE2' ' A' ' 53' ' ' PHE . 3.4 mt -57.95 -31.92 67.31 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-O 117.863 -1.065 . . . . 0.0 109.304 169.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 19.1 mmt85 -66.19 -56.9 9.06 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 120.143 1.338 . . . . 0.0 109.145 -178.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 12.3 ptmm? -67.94 -22.19 65.06 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.651 -176.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.4 t -73.16 -51.92 16.07 Favored 'General case' 0 N--CA 1.439 -1.013 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 166.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 43.1 t -60.82 -52.27 65.79 Favored 'General case' 0 CA--C 1.514 -0.442 0 C-N-CA 124.404 1.082 . . . . 0.0 112.16 -170.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.16 1.67 4.5 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.382 -0.826 . . . . 0.0 112.554 -173.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.555 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 11.6 tt0 -85.29 -11.7 54.12 Favored 'General case' 0 N--CA 1.44 -0.944 0 C-N-CA 126.451 1.9 . . . . 0.0 111.168 -179.127 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.555 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 73.8 m-85 -135.37 160.48 67.8 Favored Pre-proline 0 N--CA 1.447 -0.623 0 C-N-CA 124.907 1.283 . . . . 0.0 111.168 -168.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -65.07 120.38 7.6 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 N-CA-C 105.416 -2.571 . . . . 0.0 105.416 165.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -43.79 -40.05 4.15 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 115.158 1.54 . . . . 0.0 115.158 -167.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.58 -9.71 14.18 Favored Glycine 0 CA--C 1.533 1.202 0 C-N-CA 124.845 1.212 . . . . 0.0 114.048 178.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.43 -26.65 68.83 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 119.06 1.43 . . . . 0.0 111.478 169.517 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 11.1 t -140.23 132.12 27.63 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-O 123.235 1.493 . . . . 0.0 112.727 -169.066 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 19.1 t -68.52 -52.06 40.25 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.655 0 CA-C-N 112.762 -2.017 . . . . 0.0 108.365 175.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 12.4 m -62.86 -41.86 94.23 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 CA-C-O 118.363 -0.827 . . . . 0.0 110.313 -176.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 29.3 t -63.66 -34.11 77.12 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.669 1.588 . . . . 0.0 110.183 176.161 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.9 m -67.65 -28.72 67.96 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 122.854 0.462 . . . . 0.0 110.708 171.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -67.89 -34.03 81.29 Favored Glycine 0 C--N 1.346 1.107 0 CA-C-O 123.15 1.417 . . . . 0.0 111.315 167.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.512 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 0.6 OUTLIER -80.38 -44.34 19.56 Favored 'General case' 0 N--CA 1.421 -1.914 0 N-CA-C 115.877 1.806 . . . . 0.0 115.877 -165.64 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 . . . . . 0 C--N 1.322 -0.611 0 CA-C-O 118.779 -0.629 . . . . 0.0 110.393 170.882 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.2 t0 . . . . . 0 N--CA 1.448 -0.566 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -55.45 -33.53 86.26 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 124.204 3.269 . . . . 0.0 112.821 -175.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 63.1 m -94.61 -10.41 32.04 Favored 'General case' 0 N--CA 1.438 -1.068 0 C-N-CA 125.599 1.56 . . . . 0.0 113.19 -169.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 26.5 tp60 -62.6 -24.94 67.83 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 118.806 0.73 . . . . 0.0 111.161 -179.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -60.1 -54.38 46.58 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.434 1.094 . . . . 0.0 109.988 168.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -63.64 -38.83 92.62 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.655 0.782 . . . . 0.0 110.242 -177.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.14 -43.46 70.55 Favored 'General case' 0 C--N 1.341 0.197 0 C-N-CA 124.98 1.312 . . . . 0.0 112.645 169.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 77.8 m -57.56 -44.71 85.48 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 121.228 -0.189 . . . . 0.0 110.731 173.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -62.01 -25.81 67.87 Favored 'General case' 0 C--O 1.226 -0.137 0 CA-C-O 117.779 -1.105 . . . . 0.0 112.14 178.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 22.9 mm -59.38 -54.18 37.94 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.288 0 CA-C-N 120.251 1.387 . . . . 0.0 109.393 173.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -59.47 -53.45 58.05 Favored 'General case' 0 N--CA 1.445 -0.708 0 O-C-N 123.991 0.807 . . . . 0.0 109.014 -178.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.47 -31.99 72.52 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 118.987 -1.085 . . . . 0.0 111.664 -175.585 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.0 t -55.82 -48.03 76.16 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 119.42 1.009 . . . . 0.0 108.728 168.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.14 -47.24 83.93 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 123.279 0.632 . . . . 0.0 110.277 179.123 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -56.92 -46.25 82.12 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.45 0.7 . . . . 0.0 111.3 174.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.4 -13.97 59.86 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.017 0.927 . . . . 0.0 113.301 175.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.4 m-80 -124.13 10.32 8.73 Favored 'General case' 0 C--N 1.342 0.278 0 C-N-CA 124.458 1.103 . . . . 0.0 112.121 -173.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 14.8 m 58.22 39.99 25.24 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 119.825 1.193 . . . . 0.0 111.129 178.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.275 6.9 m-85 73.27 14.76 4.47 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 127.902 2.481 . . . . 0.0 114.774 168.635 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 50.6 mtm -66.57 85.15 0.11 Allowed 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 125.677 1.591 . . . . 0.0 110.251 169.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -56.95 -18.18 12.48 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.609 1.164 . . . . 0.0 112.157 170.124 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.4 p -61.5 -58.27 8.83 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 127.138 2.175 . . . . 0.0 110.797 167.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.5 mmtp -54.43 -41.0 68.88 Favored 'General case' 0 C--N 1.339 0.121 0 C-N-CA 123.392 0.677 . . . . 0.0 109.415 173.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.3 m -80.65 7.12 10.84 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -176.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 79.6 mm-40 -59.35 -27.42 65.92 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.833 1.197 . . . . 0.0 110.841 167.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.22 -54.3 48.41 Favored 'General case' 0 C--N 1.345 0.379 0 C-N-CA 125.513 1.525 . . . . 0.0 111.63 173.089 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.2 p -76.58 -28.74 17.88 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.811 0 C-N-CA 123.69 0.796 . . . . 0.0 109.838 -175.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 22.4 mt -59.74 -46.41 93.53 Favored 'Isoleucine or valine' 0 C--N 1.344 0.335 0 N-CA-C 107.034 -1.469 . . . . 0.0 107.034 167.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.34 -30.33 51.1 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 123.166 0.586 . . . . 0.0 112.358 173.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -78.18 -39.73 39.88 Favored 'General case' 0 N--CA 1.429 -1.518 0 C-N-CA 120.232 -0.587 . . . . 0.0 111.633 177.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.414 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.9 mt -63.65 -33.02 74.7 Favored 'General case' 0 C--N 1.343 0.315 0 CA-C-N 119.559 1.072 . . . . 0.0 110.362 172.272 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.12 -61.92 2.2 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.942 1.297 . . . . 0.0 109.406 175.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.9 ptmt -65.92 -29.76 70.23 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 114.51 -1.223 . . . . 0.0 110.888 -174.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 52.1 t -62.56 -51.21 68.27 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 168.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.6 t -60.54 -46.75 89.03 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.324 0.65 . . . . 0.0 111.309 -173.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.73 -1.94 4.42 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 125.097 1.359 . . . . 0.0 113.247 -179.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.55 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 21.0 tt0 -80.18 -10.87 59.78 Favored 'General case' 0 N--CA 1.44 -0.969 0 C-N-CA 123.969 0.907 . . . . 0.0 110.591 172.293 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.55 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 68.3 m-85 -139.37 161.06 59.25 Favored Pre-proline 0 N--CA 1.447 -0.613 0 C-N-CA 124.556 1.143 . . . . 0.0 112.476 -168.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -68.21 123.49 10.65 Favored 'Trans proline' 0 N--CA 1.457 -0.675 0 N-CA-C 104.814 -2.802 . . . . 0.0 104.814 164.095 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.0 ptmt -48.97 -33.63 11.37 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 116.5 2.037 . . . . 0.0 116.5 -166.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.85 -15.05 40.28 Favored Glycine 0 CA--C 1.532 1.134 0 CA-C-N 118.899 0.772 . . . . 0.0 113.806 178.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.8 tpm_? -64.58 -12.95 50.44 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 125.223 1.409 . . . . 0.0 112.457 171.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.9 t -149.93 141.09 23.07 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 122.478 1.132 . . . . 0.0 111.756 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.5 t -71.8 -54.12 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 CA-C-N 114.571 -1.195 . . . . 0.0 108.913 178.116 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 6.8 m -59.52 -39.46 79.38 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 122.63 0.372 . . . . 0.0 110.085 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . 0.493 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 12.2 t -67.54 -37.23 82.4 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.686 1.195 . . . . 0.0 110.176 177.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 54.1 m -63.7 -27.83 69.48 Favored 'General case' 0 N--CA 1.453 -0.32 0 O-C-N 121.883 -0.511 . . . . 0.0 110.87 172.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.29 -25.47 72.96 Favored Glycine 0 C--N 1.343 0.958 0 CA-C-O 122.025 0.791 . . . . 0.0 112.195 170.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.493 ' HB2' ' HA ' ' A' ' 50' ' ' CYS . 0.2 OUTLIER -82.35 -49.45 10.01 Favored 'General case' 0 N--CA 1.433 -1.309 0 C-N-CA 126.087 1.755 . . . . 0.0 115.12 -167.72 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 . . . . . 0 C--N 1.32 -0.676 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.105 172.787 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.8 t0 . . . . . 0 N--CA 1.447 -0.586 0 N-CA-C 106.369 -1.715 . . . . 0.0 106.369 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -56.01 -37.04 96.75 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 123.536 2.824 . . . . 0.0 112.362 -169.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 67.5 m -92.92 -8.86 42.03 Favored 'General case' 0 N--CA 1.438 -1.053 0 C-N-CA 125.707 1.603 . . . . 0.0 113.396 -168.699 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 28.8 tp60 -62.27 -25.05 67.63 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 118.321 0.509 . . . . 0.0 110.51 178.328 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.3 tmtm? -58.27 -56.93 15.69 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.387 1.075 . . . . 0.0 109.446 168.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 21.1 mp0 -61.96 -39.13 91.07 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.037 0.935 . . . . 0.0 110.749 -177.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -55.27 -44.83 76.0 Favored 'General case' 0 C--N 1.338 0.108 0 C-N-CA 124.319 1.048 . . . . 0.0 112.203 170.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.4 m -59.02 -41.65 88.28 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 121.06 -0.256 . . . . 0.0 111.078 172.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -64.26 -21.96 66.78 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-O 117.432 -1.27 . . . . 0.0 112.941 176.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.421 HD13 HG13 ' A' ' 31' ' ' VAL . 44.3 mm -59.64 -51.1 76.74 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-N 121.029 1.74 . . . . 0.0 109.34 172.593 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 8.4 mm-40 -61.14 -55.89 27.19 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 108.274 -1.009 . . . . 0.0 108.274 178.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 17.7 mtpp -66.2 -27.84 68.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 118.405 -0.807 . . . . 0.0 111.481 -172.082 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.404 ' CB ' HG11 ' A' ' 31' ' ' VAL . 15.7 t -56.71 -51.36 69.1 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 119.14 0.882 . . . . 0.0 109.034 168.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.416 HD12 ' SG ' ' A' ' 28' ' ' CYS . 0.2 OUTLIER -56.05 -46.71 78.83 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 123.524 0.729 . . . . 0.0 110.723 178.061 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.458 ' HA ' ' CE1' ' A' ' 23' ' ' TYR . 1.5 mp0 -56.86 -44.49 82.23 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 122.908 0.483 . . . . 0.0 111.635 174.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.18 -14.38 61.79 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 177.061 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -120.89 14.19 11.55 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.362 1.065 . . . . 0.0 113.248 -168.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 17.2 m 60.98 35.98 18.81 Favored 'General case' 0 C--N 1.346 0.442 0 CA-C-N 120.55 1.523 . . . . 0.0 110.035 -178.244 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.458 ' CE1' ' HA ' ' A' ' 19' ' ' GLN . 45.4 m-85 66.63 16.68 10.46 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 126.516 1.926 . . . . 0.0 113.597 168.555 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 58.0 mtm -72.27 88.04 1.14 Allowed 'General case' 0 N--CA 1.438 -1.039 0 C-N-CA 126.36 1.864 . . . . 0.0 108.808 173.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -52.85 -27.97 20.78 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.016 0.927 . . . . 0.0 110.532 170.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.0 m -57.22 -35.94 70.28 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 127.184 2.194 . . . . 0.0 113.325 171.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.5 mmtm -72.82 -43.5 62.6 Favored 'General case' 0 C--O 1.233 0.214 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 170.595 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.416 ' SG ' HD12 ' A' ' 18' ' ' LEU 0.25 74.7 m -73.42 1.42 9.77 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 123.875 0.87 . . . . 0.0 113.116 -170.495 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.418 ' HA ' HD12 ' A' ' 32' ' ' ILE . 61.6 mm-40 -55.56 -31.87 62.53 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.319 -0.863 . . . . 0.0 109.919 165.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.97 -53.48 57.78 Favored 'General case' 0 C--N 1.346 0.423 0 C-N-CA 124.531 1.132 . . . . 0.0 111.684 173.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.421 HG13 HD13 ' A' ' 14' ' ' ILE . 7.5 p -75.97 -24.47 16.6 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 C-N-CA 122.863 0.465 . . . . 0.0 110.245 -174.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.506 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 40.3 mt -62.53 -49.38 84.05 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 N-CA-C 106.561 -1.644 . . . . 0.0 106.561 167.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -55.92 -29.9 60.8 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 118.94 0.791 . . . . 0.0 111.142 174.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -71.42 -44.19 65.34 Favored 'General case' 0 N--CA 1.446 -0.628 0 O-C-N 121.313 -0.867 . . . . 0.0 112.288 175.16 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.495 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.3 mt -59.77 -33.44 71.7 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-N 119.038 0.835 . . . . 0.0 109.777 172.132 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.6 ttt-85 -62.21 -57.01 13.04 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 126.052 1.741 . . . . 0.0 110.629 178.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -62.9 -35.64 80.71 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 124.486 1.114 . . . . 0.0 110.872 -179.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.3 t -62.38 -50.27 72.24 Favored 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 169.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 52.6 t -63.94 -48.93 74.59 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 123.2 0.6 . . . . 0.0 111.724 -170.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.4 -0.65 5.14 Favored 'General case' 0 N--CA 1.444 -0.737 0 C-N-CA 124.575 1.15 . . . . 0.0 112.091 -177.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.471 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 2.1 tp-100 -80.06 -7.49 58.89 Favored 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 123.797 0.839 . . . . 0.0 110.963 173.475 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.471 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 73.3 m-85 -143.28 161.36 48.1 Favored Pre-proline 0 N--CA 1.444 -0.749 0 C-N-CA 124.286 1.035 . . . . 0.0 112.472 -168.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -69.24 110.15 2.38 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 N-CA-C 105.284 -2.622 . . . . 0.0 105.284 164.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -43.52 -30.49 0.58 Allowed 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 117.937 2.569 . . . . 0.0 117.937 -166.584 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -55.39 -16.44 9.98 Favored Glycine 0 CA--C 1.538 1.5 0 CA-C-N 119.559 1.072 . . . . 0.0 114.071 172.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 12.7 tpt180 -54.12 -28.22 38.22 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 127.062 2.145 . . . . 0.0 111.789 168.432 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.2 t -146.63 140.89 26.35 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-O 122.483 1.135 . . . . 0.0 112.36 -169.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 11.7 t -69.26 -55.66 14.54 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-N 114.107 -1.406 . . . . 0.0 108.941 178.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 7.6 m -59.21 -41.72 84.73 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 122.897 0.479 . . . . 0.0 109.915 -177.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . 0.49 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 14.0 t -67.33 -35.55 79.64 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.967 1.307 . . . . 0.0 110.044 179.211 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 54.7 m -65.95 -23.63 66.64 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 118.734 -0.651 . . . . 0.0 111.156 172.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -77.12 -26.91 61.0 Favored Glycine 0 C--N 1.345 1.04 0 CA-C-O 122.423 1.013 . . . . 0.0 111.832 168.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.506 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 0.4 OUTLIER -80.15 -41.54 25.18 Favored 'General case' 0 N--CA 1.42 -1.958 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 -166.8 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 . . . . . 0 C--N 1.322 -0.621 0 O-C-N 123.883 0.739 . . . . 0.0 111.164 177.975 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.2 t0 . . . . . 0 CA--C 1.539 0.533 0 N-CA-C 106.148 -1.797 . . . . 0.0 106.148 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo -62.04 -30.67 83.24 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 124.318 3.345 . . . . 0.0 112.685 -172.131 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 89.9 m -93.29 -14.17 27.3 Favored 'General case' 0 N--CA 1.437 -1.076 0 C-N-CA 124.863 1.265 . . . . 0.0 112.299 -168.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 21.4 tp60 -60.48 -25.53 66.12 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 123.432 0.693 . . . . 0.0 110.739 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 65.9 tttp -62.08 -56.85 14.71 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 124.14 0.976 . . . . 0.0 110.162 168.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -61.15 -37.7 83.79 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.788 0.835 . . . . 0.0 110.481 -176.355 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.49 -43.64 71.96 Favored 'General case' 0 CA--C 1.52 -0.195 0 C-N-CA 125.186 1.394 . . . . 0.0 112.826 169.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.8 m -58.75 -43.86 90.39 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 121.028 0.442 . . . . 0.0 110.817 173.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 40.2 mm-40 -64.27 -21.1 66.47 Favored 'General case' 0 N--CA 1.456 -0.151 0 CA-C-O 117.735 -1.126 . . . . 0.0 112.387 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.402 HD13 HG13 ' A' ' 31' ' ' VAL . 36.8 mm -60.12 -52.62 59.1 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 CA-C-N 120.574 1.534 . . . . 0.0 109.363 171.753 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -58.27 -55.52 33.96 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 107.624 -1.251 . . . . 0.0 107.624 -179.231 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 41.1 mtpt -70.02 -29.44 66.5 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 118.201 -0.904 . . . . 0.0 111.64 -170.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.411 ' CB ' HG11 ' A' ' 31' ' ' VAL . 16.8 t -56.87 -47.05 81.36 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 168.57 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.15 -45.45 90.93 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 118.377 -0.82 . . . . 0.0 110.133 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -58.47 -46.53 86.42 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 119.428 1.013 . . . . 0.0 111.222 174.228 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.05 -14.57 55.41 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.811 0.844 . . . . 0.0 113.24 176.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -122.56 9.16 9.58 Favored 'General case' 0 C--N 1.342 0.256 0 C-N-CA 124.228 1.011 . . . . 0.0 112.231 -173.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.6 m 58.25 40.23 24.91 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 122.601 1.191 . . . . 0.0 110.776 179.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.26 7.1 m-85 72.14 15.1 5.53 Favored 'General case' 0 N--CA 1.443 -0.812 0 C-N-CA 127.914 2.485 . . . . 0.0 114.316 169.075 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 67.3 mtm -70.44 86.82 0.62 Allowed 'General case' 0 N--CA 1.441 -0.915 0 C-N-CA 125.5 1.52 . . . . 0.0 110.047 169.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -55.05 -23.47 20.19 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 125.769 1.628 . . . . 0.0 110.569 168.183 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -55.26 -41.53 72.31 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.864 1.665 . . . . 0.0 112.004 169.576 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 50.6 mmtt -73.7 -45.68 50.83 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.991 0.916 . . . . 0.0 108.555 175.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.1 m -73.68 1.6 9.92 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -172.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 65.4 mm-40 -51.81 -34.57 40.72 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 119.105 0.866 . . . . 0.0 109.986 166.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.68 -57.4 12.9 Favored 'General case' 0 C--N 1.346 0.425 0 C-N-CA 125.757 1.623 . . . . 0.0 111.447 175.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.411 HG11 ' CB ' ' A' ' 17' ' ' CYS . 8.7 p -72.44 -29.79 32.45 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.645 0 C-N-CA 123.618 0.767 . . . . 0.0 110.194 -173.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.44 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 56.2 mt -59.97 -50.66 79.27 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 N-CA-C 106.129 -1.804 . . . . 0.0 106.129 168.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.417 HE22 ' NH1' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -56.91 -28.84 62.47 Favored 'General case' 0 N--CA 1.448 -0.574 0 O-C-N 121.635 -0.666 . . . . 0.0 112.77 175.306 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -74.99 -37.94 61.74 Favored 'General case' 0 N--CA 1.432 -1.361 0 CA-C-N 118.585 0.63 . . . . 0.0 111.39 177.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.416 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.4 mt -59.27 -34.11 71.86 Favored 'General case' 0 C--N 1.346 0.418 0 CA-C-N 119.502 1.046 . . . . 0.0 109.872 169.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.417 ' NH1' HE22 ' A' ' 33' ' ' GLN . 0.8 OUTLIER -67.13 -55.62 13.43 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.214 1.406 . . . . 0.0 111.732 179.722 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 57.4 mttm -62.09 -33.31 74.19 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 124.822 1.249 . . . . 0.0 110.326 178.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.3 t -64.2 -52.76 57.29 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 168.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.4 t -57.7 -50.31 73.63 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 123.762 0.825 . . . . 0.0 112.079 -172.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.79 -0.87 7.84 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 114.961 -1.018 . . . . 0.0 112.444 -175.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.468 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 2.7 tp-100 -85.38 -6.57 59.21 Favored 'General case' 0 N--CA 1.437 -1.111 0 C-N-CA 124.345 1.058 . . . . 0.0 111.548 179.408 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.468 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 77.9 m-85 -140.26 160.23 60.68 Favored Pre-proline 0 N--CA 1.445 -0.685 0 C-N-CA 124.472 1.109 . . . . 0.0 111.609 -168.7 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -67.37 118.17 5.38 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 N-CA-C 106.408 -2.189 . . . . 0.0 106.408 166.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 62.1 tttm -41.27 -38.15 1.1 Allowed 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 117.024 2.231 . . . . 0.0 117.024 -168.019 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.28 -13.62 16.28 Favored Glycine 0 CA--C 1.537 1.418 0 C-N-CA 123.997 0.808 . . . . 0.0 114.066 176.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.77 -31.12 64.3 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 126.381 1.872 . . . . 0.0 112.057 169.495 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.5 t -146.01 136.97 24.5 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-O 123.113 1.435 . . . . 0.0 113.798 -168.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.1 t -71.89 -54.57 16.37 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.735 0 CA-C-N 112.726 -2.034 . . . . 0.0 108.833 177.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 17.7 m -60.19 -39.36 80.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 C-N-CA 123.004 0.522 . . . . 0.0 110.558 -178.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . 0.448 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 6.3 t -66.54 -38.9 88.13 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.102 1.361 . . . . 0.0 109.954 176.328 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 51.2 m -64.88 -26.64 68.41 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-O 119.231 -0.414 . . . . 0.0 110.822 172.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.34 -26.47 71.92 Favored Glycine 0 C--N 1.342 0.915 0 CA-C-N 118.088 0.404 . . . . 0.0 112.291 169.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.448 ' HB2' ' HA ' ' A' ' 50' ' ' CYS . 0.3 OUTLIER -81.2 -48.11 12.52 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 115.893 1.812 . . . . 0.0 115.893 -165.737 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 . . . . . 0 C--N 1.32 -0.678 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.243 173.5 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.9 t0 . . . . . 0 N--CA 1.442 -0.827 0 N-CA-C 105.964 -1.865 . . . . 0.0 105.964 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -53.56 -31.51 59.59 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 124.363 3.375 . . . . 0.0 112.868 -169.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.409 ' HB3' ' CD2' ' A' ' 35' ' ' LEU . 73.0 m -94.26 -13.69 26.27 Favored 'General case' 0 N--CA 1.428 -1.553 0 C-N-CA 126.384 1.874 . . . . 0.0 112.735 -170.414 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 32.3 tp60 -63.11 -25.58 68.43 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 118.898 0.772 . . . . 0.0 110.767 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -60.37 -53.62 55.45 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.979 0.912 . . . . 0.0 110.191 169.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -64.86 -38.97 92.74 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.249 0.62 . . . . 0.0 110.155 -178.162 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.07 -45.33 71.7 Favored 'General case' 0 C--N 1.341 0.216 0 C-N-CA 125.186 1.394 . . . . 0.0 112.061 169.537 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 89.1 m -57.33 -43.05 83.05 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 117.632 0.196 . . . . 0.0 110.473 173.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -65.06 -25.29 67.75 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-O 117.547 -1.216 . . . . 0.0 113.053 176.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 30.2 mm -58.71 -52.01 65.1 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 CA-C-N 120.677 1.581 . . . . 0.0 108.961 171.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -60.8 -53.5 56.65 Favored 'General case' 0 N--CA 1.442 -0.862 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 -175.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 16.2 mtpp -69.28 -31.1 69.38 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 118.215 -0.898 . . . . 0.0 111.849 -174.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.9 t -56.87 -45.9 82.18 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 169.026 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.6 -45.26 92.44 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-O 118.481 -0.771 . . . . 0.0 110.467 179.162 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -58.43 -44.81 89.26 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 119.219 0.918 . . . . 0.0 111.314 173.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.24 -13.46 58.38 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 113.345 0.869 . . . . 0.0 113.345 175.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 -124.82 9.35 8.22 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 124.483 1.113 . . . . 0.0 112.405 -172.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.3 m 58.04 40.12 25.69 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 122.318 1.056 . . . . 0.0 110.862 179.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.258 6.7 m-85 72.23 13.35 5.71 Favored 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 127.854 2.462 . . . . 0.0 114.661 168.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 67.3 mtm -70.78 85.87 0.67 Allowed 'General case' 0 N--CA 1.442 -0.851 0 C-N-CA 125.039 1.336 . . . . 0.0 109.798 170.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -53.58 -25.85 19.08 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.178 0.591 . . . . 0.0 111.45 171.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.1 m -51.09 -42.02 60.36 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 126.13 1.772 . . . . 0.0 112.317 170.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 55.1 mmtt -70.89 -47.59 58.34 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 124.188 0.995 . . . . 0.0 108.93 174.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.2 m -72.7 2.71 6.07 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 124.662 1.185 . . . . 0.0 113.171 -174.408 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 52.4 mm-40 -56.23 -28.25 57.78 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 119.814 1.188 . . . . 0.0 109.874 166.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.97 -56.24 24.33 Favored 'General case' 0 C--N 1.346 0.44 0 C-N-CA 125.313 1.445 . . . . 0.0 111.833 172.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.1 p -75.74 -26.02 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.746 0 C-N-CA 123.625 0.77 . . . . 0.0 109.826 -174.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.544 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 57.6 mt -62.75 -44.3 99.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 N-CA-C 107.309 -1.367 . . . . 0.0 107.309 168.517 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.466 HE22 ' NH1' ' A' ' 36' ' ' ARG . 2.9 tp-100 -56.47 -28.33 59.4 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 123.506 0.723 . . . . 0.0 112.379 172.401 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -74.98 -44.02 50.69 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 118.571 0.623 . . . . 0.0 111.854 173.011 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.512 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.6 mt -63.64 -30.89 71.94 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 119.294 0.952 . . . . 0.0 110.901 175.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.466 ' NH1' HE22 ' A' ' 33' ' ' GLN . 0.2 OUTLIER -57.26 -59.29 5.34 Favored 'General case' 0 CA--C 1.519 -0.233 0 C-N-CA 124.443 1.097 . . . . 0.0 109.415 173.502 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 48.8 mttp -60.04 -37.7 80.57 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 113.751 -1.568 . . . . 0.0 110.972 -177.295 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 42.5 t -62.2 -52.18 64.84 Favored 'General case' 0 N--CA 1.442 -0.861 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 171.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.5 t -61.6 -45.26 94.84 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.532 0.733 . . . . 0.0 111.888 -171.343 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.75 -2.4 11.85 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.095 -0.957 . . . . 0.0 112.883 -177.343 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.469 ' HB3' ' CE1' ' A' ' 42' ' ' TYR . 2.6 tp-100 -86.3 -5.53 59.16 Favored 'General case' 0 N--CA 1.438 -1.027 0 C-N-CA 124.651 1.18 . . . . 0.0 111.565 -178.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.469 ' CE1' ' HB3' ' A' ' 41' ' ' GLN . 82.7 m-85 -139.38 160.89 60.03 Favored Pre-proline 0 N--CA 1.445 -0.715 0 C-N-CA 125.13 1.372 . . . . 0.0 110.708 -168.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -67.42 111.12 2.22 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 N-CA-C 104.574 -2.895 . . . . 0.0 104.574 165.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 36.4 mmtm -39.43 -40.54 0.84 Allowed 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 116.753 2.131 . . . . 0.0 116.753 -165.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.5 -11.81 11.28 Favored Glycine 0 CA--C 1.536 1.398 0 C-N-CA 124.679 1.133 . . . . 0.0 114.303 176.259 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 31.9 tpt85 -52.52 -33.83 47.06 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 127.072 2.149 . . . . 0.0 111.675 169.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.0 t -140.71 140.75 34.94 Favored 'General case' 0 N--CA 1.44 -0.966 0 CA-C-O 122.424 1.107 . . . . 0.0 111.703 -167.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 8.8 t -70.34 -54.27 19.26 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 CA-C-N 113.828 -1.533 . . . . 0.0 108.781 179.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 7.0 m -61.48 -38.05 79.19 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-O 119.211 -0.423 . . . . 0.0 110.376 -178.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . 0.467 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 11.9 t -67.32 -37.73 83.79 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.378 1.071 . . . . 0.0 109.93 176.67 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 45.2 m -64.97 -27.04 68.57 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.817 -0.552 . . . . 0.0 110.649 172.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -71.36 -26.84 72.61 Favored Glycine 0 C--N 1.344 0.993 0 CA-C-O 121.74 0.633 . . . . 0.0 112.136 169.485 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.544 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 0.2 OUTLIER -82.04 -48.18 11.73 Favored 'General case' 0 N--CA 1.432 -1.34 0 C-N-CA 126.059 1.744 . . . . 0.0 115.074 -167.153 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 . . . . . 0 CA--C 1.543 0.681 0 CA-C-O 118.732 -0.651 . . . . 0.0 110.794 172.292 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 39.5 t0 . . . . . 0 CA--C 1.541 0.63 0 CA-C-O 118.267 -0.873 . . . . 0.0 109.977 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -55.15 -32.02 78.19 Favored 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 124.37 3.38 . . . . 0.0 113.418 -176.134 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 66.3 m -98.53 -10.98 22.7 Favored 'General case' 0 N--CA 1.437 -1.099 0 C-N-CA 125.929 1.692 . . . . 0.0 113.36 -168.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 20.2 tp60 -64.09 -25.91 68.31 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 118.614 0.643 . . . . 0.0 111.126 -179.104 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -59.34 -55.78 30.43 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.016 0.926 . . . . 0.0 109.54 169.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -63.92 -36.05 82.67 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.539 0.735 . . . . 0.0 110.126 -177.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -60.46 -39.16 86.57 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 124.047 0.939 . . . . 0.0 112.065 174.095 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 70.9 m -58.18 -44.76 88.19 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 118.494 0.588 . . . . 0.0 110.553 171.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 30.4 mm-40 -64.58 -22.68 67.04 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 117.745 -1.122 . . . . 0.0 112.393 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.424 HD13 HG13 ' A' ' 31' ' ' VAL . 43.8 mm -58.55 -55.14 24.65 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.263 0 CA-C-N 120.377 1.444 . . . . 0.0 109.302 171.161 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -60.31 -53.04 62.39 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 -177.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 16.0 mtpp -68.12 -30.74 69.97 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 118.264 -0.874 . . . . 0.0 111.495 -174.011 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.8 t -58.49 -47.77 83.01 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 119.412 1.005 . . . . 0.0 108.657 168.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.74 -46.96 83.75 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 123.235 0.614 . . . . 0.0 110.178 179.555 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -57.42 -44.67 84.82 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.777 0.831 . . . . 0.0 111.39 173.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.72 -13.21 61.06 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 174.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 45.2 m-80 -124.25 8.46 8.51 Favored 'General case' 0 C--N 1.343 0.284 0 C-N-CA 124.515 1.126 . . . . 0.0 112.304 -172.129 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.1 m 59.0 40.31 22.47 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 122.44 1.115 . . . . 0.0 110.807 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.272 7.1 m-85 72.11 14.48 5.66 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 127.697 2.399 . . . . 0.0 114.649 168.636 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 60.7 mtm -69.38 84.64 0.4 Allowed 'General case' 0 N--CA 1.441 -0.875 0 C-N-CA 125.403 1.481 . . . . 0.0 110.218 169.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 51.3 tt0 -54.0 -23.18 12.45 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.066 1.347 . . . . 0.0 111.955 169.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.7 m -58.61 -47.59 83.84 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 126.114 1.765 . . . . 0.0 111.699 169.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.4 mmtm -64.64 -47.95 76.63 Favored 'General case' 0 C--N 1.342 0.244 0 C-N-CA 124.095 0.958 . . . . 0.0 108.897 175.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 71.5 m -68.95 2.13 2.9 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 124.601 1.16 . . . . 0.0 113.186 -179.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -54.58 -27.62 40.25 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 119.826 1.194 . . . . 0.0 111.598 167.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.62 -54.66 43.94 Favored 'General case' 0 C--N 1.344 0.354 0 C-N-CA 124.747 1.219 . . . . 0.0 111.936 172.155 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.424 HG13 HD13 ' A' ' 14' ' ' ILE . 10.0 p -77.62 -30.58 16.93 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.738 0 C-N-CA 123.483 0.713 . . . . 0.0 110.192 -173.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.635 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 57.9 mt -63.54 -42.26 95.52 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 169.563 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.99 -40.47 66.96 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-N 119.981 1.264 . . . . 0.0 111.547 169.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -70.08 -39.82 75.36 Favored 'General case' 0 N--CA 1.435 -1.222 0 C-N-CA 118.975 -1.09 . . . . 0.0 110.345 -178.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.503 HD13 ' CD1' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -71.3 -27.68 63.58 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 123.654 0.782 . . . . 0.0 110.046 179.378 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.596 HH11 HG22 ' A' ' 32' ' ' ILE . 0.3 OUTLIER -62.25 -59.09 5.53 Favored 'General case' 0 CA--C 1.519 -0.227 0 C-N-CA 126.616 1.967 . . . . 0.0 107.714 172.053 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 58.0 mttm -59.04 -38.99 80.62 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 114.489 -1.232 . . . . 0.0 110.462 -178.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 43.7 t -59.25 -54.23 49.25 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 123.79 0.836 . . . . 0.0 108.955 172.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 47.3 t -60.42 -42.58 96.3 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 121.593 0.711 . . . . 0.0 111.922 -173.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.44 -3.35 11.04 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.787 1.235 . . . . 0.0 113.466 -179.358 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.563 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 20.7 tt0 -84.39 -9.48 58.38 Favored 'General case' 0 N--CA 1.44 -0.959 0 C-N-CA 124.381 1.073 . . . . 0.0 111.019 178.203 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.563 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 71.6 m-85 -140.37 160.98 57.53 Favored Pre-proline 0 N--CA 1.446 -0.671 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -166.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -69.66 125.83 12.66 Favored 'Trans proline' 0 N--CA 1.457 -0.633 0 N-CA-C 105.312 -2.611 . . . . 0.0 105.312 164.399 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 37.8 mmtt -52.91 -31.38 39.56 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 115.362 1.616 . . . . 0.0 115.362 -165.365 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.12 -13.16 26.45 Favored Glycine 0 CA--C 1.535 1.315 0 C-N-CA 124.014 0.816 . . . . 0.0 113.975 175.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.595 HH11 ' HG3' ' A' ' 46' ' ' ARG . 3.9 tpm_? -65.48 -15.38 62.59 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.481 1.912 . . . . 0.0 112.748 169.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.1 t -153.26 137.57 16.61 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 120.095 1.316 . . . . 0.0 112.612 -173.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 20.4 t -68.26 -55.65 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.658 0 CA-C-N 113.784 -1.553 . . . . 0.0 108.813 174.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 7.5 m -61.26 -43.65 96.91 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 CA-C-O 118.881 -0.581 . . . . 0.0 110.079 -174.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 11.1 t -63.87 -33.55 75.95 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.776 1.631 . . . . 0.0 110.01 178.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 61.5 m -67.1 -26.2 66.59 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 119.127 -0.463 . . . . 0.0 111.118 172.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.77 -33.4 57.89 Favored Glycine 0 C--N 1.345 1.042 0 CA-C-O 123.313 1.507 . . . . 0.0 111.055 167.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.635 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 0.7 OUTLIER -78.23 -41.72 33.4 Favored 'General case' 0 N--CA 1.42 -1.932 0 N-CA-C 116.318 1.969 . . . . 0.0 116.318 -164.82 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 . . . . . 0 C--N 1.321 -0.64 0 CA-C-O 118.483 -0.77 . . . . 0.0 111.675 170.95 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.429 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 40.3 t0 . . . . . 0 CA--C 1.543 0.705 0 CA-C-O 119.244 -0.408 . . . . 0.0 109.938 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.455 ' HD3' ' HE ' ' A' ' 46' ' ' ARG . 23.6 Cg_exo -66.22 -32.04 43.2 Favored 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 125.073 3.849 . . . . 0.0 112.593 -174.499 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.453 ' HB3' ' CD2' ' A' ' 35' ' ' LEU . 99.1 m -93.85 -16.05 24.46 Favored 'General case' 0 N--CA 1.437 -1.075 0 C-N-CA 124.78 1.232 . . . . 0.0 112.562 -167.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 20.7 tp60 -59.67 -25.56 64.83 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 123.731 0.812 . . . . 0.0 111.114 177.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 51.5 tttm -61.03 -57.27 13.28 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.629 1.172 . . . . 0.0 110.097 168.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -61.64 -40.24 94.21 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.687 0.795 . . . . 0.0 110.392 -176.437 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.01 -45.89 52.33 Favored 'General case' 0 C--N 1.341 0.204 0 C-N-CA 125.334 1.454 . . . . 0.0 112.226 169.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 86.4 m -59.54 -45.46 91.72 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.738 -0.21 . . . . 0.0 110.642 175.517 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -60.4 -30.68 69.75 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 118.534 -0.746 . . . . 0.0 111.529 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.1 mt -64.8 -49.56 79.5 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.568 0 CA-C-N 119.451 1.023 . . . . 0.0 110.316 177.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.8 mm-40 -54.66 -56.06 23.12 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 124.118 0.886 . . . . 0.0 109.127 176.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 7.9 mptt -66.02 -33.29 75.48 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 119.592 -0.843 . . . . 0.0 111.878 -176.369 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 13.1 t -54.11 -49.16 69.77 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-N 119.22 0.918 . . . . 0.0 108.536 168.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.55 -47.49 84.06 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 123.878 0.871 . . . . 0.0 110.126 179.022 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -56.23 -46.94 79.33 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.603 0.761 . . . . 0.0 111.223 174.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.35 -13.2 60.24 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.1 0.96 . . . . 0.0 113.556 176.091 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -121.68 8.02 10.02 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.674 1.19 . . . . 0.0 111.989 -173.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 59.12 40.18 22.18 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 122.392 1.091 . . . . 0.0 110.694 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.265 7.5 m-85 72.05 14.72 5.69 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 127.911 2.485 . . . . 0.0 114.635 168.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 63.5 mtm -68.82 85.44 0.32 Allowed 'General case' 0 N--CA 1.44 -0.964 0 C-N-CA 125.086 1.354 . . . . 0.0 110.117 169.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -55.54 -19.31 9.53 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.568 1.147 . . . . 0.0 111.456 169.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.6 m -59.28 -40.71 86.99 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 127.314 2.246 . . . . 0.0 112.1 169.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.2 mmtm -73.33 -47.13 45.05 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 124.409 1.084 . . . . 0.0 108.764 175.155 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 76.3 m -73.53 6.82 2.75 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 125.211 1.404 . . . . 0.0 112.458 -177.659 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 61.5 mm-40 -53.85 -37.42 63.64 Favored 'General case' 0 C--N 1.341 0.206 0 O-C-N 120.858 -1.151 . . . . 0.0 110.601 167.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.32 -51.33 69.97 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.919 0.888 . . . . 0.0 111.706 179.132 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 5.8 p -75.69 -26.34 17.99 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.775 0 C-N-CA 123.084 0.554 . . . . 0.0 110.199 -176.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.563 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 58.2 mt -62.22 -49.79 82.61 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 167.75 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.615 HE21 ' NH2' ' A' ' 36' ' ' ARG . 2.0 tt0 -54.87 -33.26 61.71 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 118.962 0.801 . . . . 0.0 111.66 175.37 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -68.6 -41.81 79.07 Favored 'General case' 0 N--CA 1.441 -0.918 0 CA-C-O 119.024 -0.512 . . . . 0.0 111.87 174.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.49 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.6 mt -63.57 -37.1 86.04 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 117.203 -1.38 . . . . 0.0 110.984 173.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.615 ' NH2' HE21 ' A' ' 33' ' ' GLN . 2.1 ptt180 -69.1 -40.93 78.09 Favored 'General case' 0 C--N 1.344 0.328 0 CA-C-N 120.625 1.557 . . . . 0.0 109.952 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -63.07 -41.48 99.45 Favored 'General case' 0 C--N 1.341 0.235 0 CA-C-O 119.457 -0.306 . . . . 0.0 111.17 175.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.1 t -57.42 -51.69 68.39 Favored 'General case' 0 C--O 1.22 -0.483 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 172.186 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.3 t -58.87 -48.3 81.87 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 124.417 1.087 . . . . 0.0 111.879 -172.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.78 -1.23 6.61 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.243 -0.89 . . . . 0.0 112.781 -177.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.545 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 20.1 tt0 -80.98 -10.96 59.65 Favored 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 124.208 1.003 . . . . 0.0 110.893 175.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.545 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 83.6 m-85 -135.07 157.88 76.0 Favored Pre-proline 0 N--CA 1.445 -0.715 0 C-N-CA 125.304 1.442 . . . . 0.0 110.807 -168.578 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -67.57 105.75 1.14 Allowed 'Trans proline' 0 N--CA 1.455 -0.783 0 N-CA-C 104.671 -2.857 . . . . 0.0 104.671 166.324 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 22.5 pttp -39.14 -38.74 0.51 Allowed 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 117.895 2.554 . . . . 0.0 117.895 -164.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.02 -15.09 19.69 Favored Glycine 0 CA--C 1.536 1.379 0 CA-C-N 119.365 0.984 . . . . 0.0 114.04 175.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.455 ' HE ' ' HD3' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -57.5 -27.44 62.54 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 126.281 1.833 . . . . 0.0 112.853 170.06 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.8 t -134.95 137.44 43.1 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-O 122.663 1.22 . . . . 0.0 110.865 -173.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 21.6 t -70.66 -55.9 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 CA-C-N 113.904 -1.498 . . . . 0.0 108.797 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 9.7 m -58.44 -43.02 85.77 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 CA-C-O 119.203 -0.427 . . . . 0.0 110.004 -178.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . 0.459 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 11.4 t -64.67 -35.67 81.78 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.764 1.625 . . . . 0.0 110.1 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 52.5 m -66.02 -25.5 67.09 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 118.959 -0.543 . . . . 0.0 110.921 172.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.42 -40.32 54.92 Favored Glycine 0 C--N 1.344 0.987 0 CA-C-O 123.935 1.853 . . . . 0.0 110.719 167.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.563 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 0.5 OUTLIER -69.45 -40.5 77.14 Favored 'General case' 0 N--CA 1.421 -1.924 0 C-N-CA 126.136 1.774 . . . . 0.0 115.564 -166.319 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 . . . . . 0 C--N 1.32 -0.693 0 CA-C-O 118.704 -0.665 . . . . 0.0 111.507 174.501 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.9 t0 . . . . . 0 CA--C 1.536 0.406 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -57.19 -31.06 89.46 Favored 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 124.039 3.159 . . . . 0.0 112.901 -175.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 54.7 m -94.27 -10.47 32.76 Favored 'General case' 0 N--CA 1.437 -1.108 0 C-N-CA 125.362 1.465 . . . . 0.0 113.052 -169.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 27.7 tp60 -63.21 -24.54 67.92 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 118.447 0.567 . . . . 0.0 111.256 -179.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.6 tppt? -60.48 -53.76 53.65 Favored 'General case' 0 C--N 1.339 0.132 0 C-N-CA 122.991 0.517 . . . . 0.0 109.97 169.276 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -62.49 -39.66 94.2 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.551 0.741 . . . . 0.0 110.004 -177.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -53.97 -45.9 71.52 Favored 'General case' 0 C--N 1.343 0.308 0 C-N-CA 125.044 1.338 . . . . 0.0 112.34 169.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 67.6 m -57.92 -42.76 85.47 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 121.333 -0.147 . . . . 0.0 110.786 174.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -65.04 -22.7 67.02 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-O 117.604 -1.189 . . . . 0.0 112.706 178.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 27.8 mm -59.41 -52.83 56.25 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.244 0 CA-C-N 120.515 1.507 . . . . 0.0 108.962 172.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 33.7 mm-40 -58.34 -53.97 52.24 Favored 'General case' 0 N--CA 1.442 -0.828 0 O-C-N 123.989 0.806 . . . . 0.0 109.051 178.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 57.1 mmtt -68.17 -30.93 70.15 Favored 'General case' 0 N--CA 1.457 -0.078 0 C-N-CA 118.507 -1.277 . . . . 0.0 111.555 -173.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 19.4 t -56.85 -48.73 77.41 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 168.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.93 -46.73 84.59 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 123.203 0.601 . . . . 0.0 110.53 179.353 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -57.16 -45.78 83.32 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.751 0.821 . . . . 0.0 111.231 174.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.98 -12.47 55.22 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 175.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -124.38 8.56 8.43 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.695 1.198 . . . . 0.0 112.387 -172.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 58.49 40.1 24.3 Favored 'General case' 0 C--N 1.345 0.393 0 CA-C-O 122.418 1.104 . . . . 0.0 110.913 179.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.259 7.0 m-85 71.88 13.7 6.02 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 127.826 2.45 . . . . 0.0 114.692 168.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 66.0 mtm -69.98 85.59 0.52 Allowed 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 125.051 1.34 . . . . 0.0 109.791 170.115 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -54.04 -24.93 18.89 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.283 0.633 . . . . 0.0 111.504 171.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.2 m -52.63 -40.33 62.66 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 126.293 1.837 . . . . 0.0 112.297 170.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.1 mmtm -71.79 -46.42 58.37 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.212 1.005 . . . . 0.0 108.794 174.218 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.7 m -74.67 5.29 5.03 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 124.749 1.219 . . . . 0.0 113.222 -173.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 -57.66 -26.8 62.18 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 119.196 0.907 . . . . 0.0 110.674 166.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.55 -55.7 31.18 Favored 'General case' 0 C--N 1.346 0.446 0 C-N-CA 126.21 1.804 . . . . 0.0 111.709 171.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.6 p -76.07 -27.02 17.75 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.69 0 C-N-CA 123.693 0.797 . . . . 0.0 109.759 -175.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 26.4 mt -62.41 -45.9 97.68 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 168.086 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -52.13 -36.9 52.65 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 118.755 0.707 . . . . 0.0 111.265 171.698 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -71.55 -43.38 66.49 Favored 'General case' 0 N--CA 1.433 -1.311 0 CA-C-O 118.633 -0.699 . . . . 0.0 111.678 178.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.496 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.3 mt -63.37 -31.73 72.96 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 119.637 1.108 . . . . 0.0 110.668 173.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.456 HH11 ' HG3' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -60.67 -58.47 8.32 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.495 1.118 . . . . 0.0 108.783 177.363 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 55.9 mtpt -62.32 -35.64 79.7 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 113.862 -1.517 . . . . 0.0 111.143 -178.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 41.8 t -60.9 -51.83 67.6 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 170.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 51.5 t -62.79 -49.16 76.08 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 123.406 0.682 . . . . 0.0 111.647 -170.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.05 -1.39 5.79 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.111 -0.95 . . . . 0.0 112.551 -177.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.435 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 2.2 tp-100 -84.5 -7.18 59.36 Favored 'General case' 0 N--CA 1.435 -1.194 0 C-N-CA 124.735 1.214 . . . . 0.0 111.476 177.298 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.435 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 72.9 m-85 -139.67 160.72 60.09 Favored Pre-proline 0 N--CA 1.446 -0.644 0 C-N-CA 124.705 1.202 . . . . 0.0 111.23 -169.43 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -67.29 120.14 7.19 Favored 'Trans proline' 0 N--CA 1.455 -0.788 0 N-CA-C 105.36 -2.592 . . . . 0.0 105.36 165.295 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -47.73 -32.11 5.49 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 116.086 1.884 . . . . 0.0 116.086 -167.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.33 -15.12 36.88 Favored Glycine 0 CA--C 1.536 1.364 0 CA-C-N 118.782 0.719 . . . . 0.0 113.769 176.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.89 -11.41 46.76 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 126.055 1.742 . . . . 0.0 112.419 170.058 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.0 t -153.74 136.75 15.49 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-O 123.104 1.43 . . . . 0.0 113.058 -178.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.0 t -70.52 -53.51 22.28 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 CA-C-N 113.463 -1.699 . . . . 0.0 108.798 176.269 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.9 m -59.73 -41.69 86.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-O 119.264 -0.398 . . . . 0.0 110.029 -178.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . 0.447 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 10.7 t -64.42 -37.45 87.57 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.51 1.524 . . . . 0.0 110.16 177.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 48.8 m -66.17 -23.58 66.49 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 118.949 -0.548 . . . . 0.0 111.264 173.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -77.01 -25.85 63.44 Favored Glycine 0 C--N 1.346 1.089 0 CA-C-O 123.194 1.441 . . . . 0.0 111.781 168.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.496 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -81.67 -41.67 21.05 Favored 'General case' 0 N--CA 1.428 -1.538 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 -166.114 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 . . . . . 0 C--N 1.323 -0.586 0 CA-C-O 119.174 -0.441 . . . . 0.0 110.647 171.334 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 44.7 t0 . . . . . 0 CA--C 1.541 0.599 0 CA-C-O 118.314 -0.85 . . . . 0.0 110.993 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -55.08 -31.93 77.26 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 124.177 3.251 . . . . 0.0 113.228 -178.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 84.4 m -96.77 -11.01 25.54 Favored 'General case' 0 N--CA 1.438 -1.073 0 C-N-CA 126.013 1.725 . . . . 0.0 113.6 -169.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.1 tp60 -64.12 -26.03 68.36 Favored 'General case' 0 N--CA 1.444 -0.775 0 CA-C-N 118.294 0.497 . . . . 0.0 110.721 -179.158 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.6 tptt -59.91 -56.11 25.84 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.537 0.735 . . . . 0.0 109.811 169.395 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -60.72 -39.7 89.58 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.117 0.567 . . . . 0.0 109.932 -177.192 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.43 -41.81 85.89 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.991 1.316 . . . . 0.0 112.451 171.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 98.3 m -59.71 -44.13 93.82 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.673 0.67 . . . . 0.0 110.627 171.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -64.97 -20.11 66.32 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 117.69 -1.148 . . . . 0.0 112.44 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 29.6 mm -59.04 -54.09 38.93 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 CA-C-N 120.538 1.517 . . . . 0.0 109.186 170.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 6.7 mm-40 -60.49 -53.38 58.27 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 -178.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 24.6 mttm -68.0 -30.29 69.51 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 118.222 -0.894 . . . . 0.0 111.583 -173.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 15.7 t -58.28 -47.73 82.69 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 119.386 0.994 . . . . 0.0 108.52 168.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.69 -46.83 83.8 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 118.843 -0.599 . . . . 0.0 110.282 178.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -57.55 -44.63 85.34 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.558 0.743 . . . . 0.0 111.419 173.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.85 -13.23 61.38 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 175.143 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 -123.67 8.22 8.86 Favored 'General case' 0 C--N 1.343 0.301 0 C-N-CA 124.725 1.21 . . . . 0.0 112.277 -172.365 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.3 m 58.84 40.14 23.16 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 122.37 1.081 . . . . 0.0 110.774 179.715 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.26 7.1 m-85 72.02 13.93 5.83 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 127.816 2.446 . . . . 0.0 114.563 168.681 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 68.1 mtm -70.77 83.27 0.64 Allowed 'General case' 0 N--CA 1.441 -0.881 0 C-N-CA 125.293 1.437 . . . . 0.0 109.777 170.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -54.41 -23.57 16.37 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.914 0.886 . . . . 0.0 111.79 172.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 4.3 m -51.98 -42.82 63.24 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 126.096 1.758 . . . . 0.0 111.907 169.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 48.4 mmtt -69.54 -48.02 61.79 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 124.559 1.144 . . . . 0.0 108.891 175.204 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.0 m -72.27 1.27 7.99 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 124.584 1.154 . . . . 0.0 113.307 -173.615 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 86.7 mm-40 -55.94 -26.77 49.35 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.477 1.035 . . . . 0.0 111.139 166.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.47 -57.9 10.91 Favored 'General case' 0 C--N 1.347 0.466 0 C-N-CA 125.5 1.52 . . . . 0.0 111.677 171.198 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 14.0 p -74.82 -29.47 22.8 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.76 0 C-N-CA 123.68 0.792 . . . . 0.0 110.145 -173.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.433 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 63.8 mt -58.77 -50.83 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.649 0 N-CA-C 105.402 -2.073 . . . . 0.0 105.402 167.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.403 ' HA ' ' HG3' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -56.28 -35.48 67.53 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 119.232 0.923 . . . . 0.0 112.869 175.077 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -68.31 -35.31 77.63 Favored 'General case' 0 N--CA 1.438 -1.05 0 C-N-CA 118.995 -1.082 . . . . 0.0 110.027 179.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.493 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -65.79 -26.33 67.65 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 125.155 1.382 . . . . 0.0 109.885 173.311 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.403 ' HG3' ' HA ' ' A' ' 33' ' ' GLN . 20.0 mmt85 -71.28 -50.92 27.72 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 177.534 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 67.2 mmtt -65.87 -25.08 67.02 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.247 179.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 47.6 t -70.36 -55.17 9.77 Favored 'General case' 0 N--CA 1.441 -0.922 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 167.257 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.3 t -60.27 -46.93 88.1 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 121.234 -0.916 . . . . 0.0 112.656 -170.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.12 2.05 6.48 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -175.188 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.57 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 11.6 tt0 -90.36 -8.99 49.34 Favored 'General case' 0 N--CA 1.442 -0.837 0 C-N-CA 126.123 1.769 . . . . 0.0 111.234 -175.681 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.57 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 74.9 m-85 -139.45 160.61 61.01 Favored Pre-proline 0 N--CA 1.445 -0.706 0 C-N-CA 124.637 1.175 . . . . 0.0 111.978 -167.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -66.12 127.97 18.64 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 N-CA-C 105.574 -2.51 . . . . 0.0 105.574 165.065 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -53.24 -32.26 47.46 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 114.271 1.211 . . . . 0.0 114.271 -166.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.82 -9.13 18.37 Favored Glycine 0 CA--C 1.535 1.343 0 C-N-CA 124.566 1.079 . . . . 0.0 114.236 175.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.3 tpm_? -68.44 -17.37 64.19 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 126.172 1.789 . . . . 0.0 112.406 169.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.9 t -149.97 137.95 20.25 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 122.641 1.21 . . . . 0.0 113.306 -170.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 26.2 t -70.11 -56.35 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 113.536 -1.665 . . . . 0.0 108.726 172.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 12.5 m -62.87 -41.72 93.71 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 CA-C-O 118.637 -0.696 . . . . 0.0 110.397 -172.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 28.0 t -63.06 -33.81 76.23 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.244 1.418 . . . . 0.0 110.118 176.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 56.9 m -67.92 -21.09 65.13 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 118.549 -0.739 . . . . 0.0 111.363 172.413 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -75.38 -39.95 34.56 Favored Glycine 0 C--N 1.344 1.004 0 CA-C-O 124.202 2.001 . . . . 0.0 110.796 166.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.493 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 1.2 t80 -73.92 -40.55 63.05 Favored 'General case' 0 N--CA 1.417 -2.097 0 CA-C-N 112.016 -2.092 . . . . 0.0 116.546 -163.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 . . . . . 0 C--N 1.321 -0.642 0 C-N-CA 119.86 -0.736 . . . . 0.0 110.937 170.652 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 24.6 t0 . . . . . 0 N--CA 1.439 -0.979 0 N-CA-C 104.437 -2.431 . . . . 0.0 104.437 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -56.21 -30.04 78.2 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 123.91 3.073 . . . . 0.0 112.702 -169.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 69.7 m -94.25 -10.89 31.47 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.56 1.544 . . . . 0.0 112.772 -171.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 22.2 tp60 -63.94 -25.09 67.98 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 118.618 0.645 . . . . 0.0 111.045 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 46.3 tttm -59.76 -55.9 28.5 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.624 1.17 . . . . 0.0 110.024 168.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 -65.25 -33.76 76.76 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.016 0.527 . . . . 0.0 110.072 -178.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -62.52 -40.27 96.24 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.535 0.734 . . . . 0.0 112.102 172.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 74.2 m -59.03 -44.97 91.81 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.411 0.55 . . . . 0.0 110.017 171.045 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -60.05 -28.1 67.49 Favored 'General case' 0 C--O 1.226 -0.133 0 CA-C-O 117.739 -1.124 . . . . 0.0 112.037 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 43.8 mm -57.76 -55.29 22.42 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.248 0 CA-C-N 120.013 1.279 . . . . 0.0 109.703 173.052 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -57.83 -55.15 38.61 Favored 'General case' 0 N--CA 1.444 -0.725 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 -178.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.6 mptp? -66.98 -31.99 72.92 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 118.824 -1.151 . . . . 0.0 111.789 -174.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 21.2 t -56.14 -48.46 76.21 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 119.532 1.06 . . . . 0.0 108.746 169.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.62 -47.02 85.76 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 123.208 0.603 . . . . 0.0 110.5 179.565 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -57.04 -45.79 82.9 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.608 0.763 . . . . 0.0 111.197 174.367 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.71 -13.12 58.65 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.128 0.971 . . . . 0.0 113.406 175.627 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 -123.66 8.89 8.89 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 124.579 1.152 . . . . 0.0 112.197 -173.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 57.91 40.31 25.91 Favored 'General case' 0 C--N 1.345 0.41 0 CA-C-O 122.437 1.113 . . . . 0.0 110.989 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.262 6.8 m-85 72.34 13.93 5.5 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 127.803 2.441 . . . . 0.0 114.445 168.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 68.5 mtm -70.67 84.51 0.63 Allowed 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 125.118 1.367 . . . . 0.0 109.866 170.622 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -53.89 -24.01 14.62 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.892 0.877 . . . . 0.0 111.679 171.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.7 m -53.37 -40.37 64.94 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.028 1.731 . . . . 0.0 112.304 170.462 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 51.8 mmtt -71.92 -47.48 52.27 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.375 1.07 . . . . 0.0 108.778 174.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 71.6 m -72.53 1.89 7.33 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.771 1.229 . . . . 0.0 113.356 -174.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 74.7 mm-40 -54.76 -27.54 41.92 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 119.587 1.085 . . . . 0.0 110.911 167.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.47 -57.63 12.14 Favored 'General case' 0 C--N 1.347 0.467 0 C-N-CA 126.011 1.724 . . . . 0.0 111.961 172.48 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.0 p -74.41 -29.73 24.71 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.722 0 C-N-CA 123.712 0.805 . . . . 0.0 109.7 -174.333 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.617 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 72.5 mt -61.74 -45.33 98.92 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 169.207 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.64 -38.73 69.93 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 118.702 0.683 . . . . 0.0 111.914 172.551 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -70.93 -40.22 72.21 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 118.482 -1.287 . . . . 0.0 109.966 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.504 HD13 ' CE1' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -66.13 -26.78 67.6 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.877 0.871 . . . . 0.0 109.786 178.026 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.71 -56.03 12.42 Favored 'General case' 0 CA--C 1.513 -0.443 0 C-N-CA 125.193 1.397 . . . . 0.0 108.578 176.38 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 7.9 mptt -61.01 -32.53 72.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 113.519 -1.673 . . . . 0.0 110.436 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 47.4 t -63.94 -55.97 18.61 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 168.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 52.8 t -58.89 -46.54 87.62 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 124.007 0.923 . . . . 0.0 112.457 -170.097 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.87 -3.01 13.9 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.249 -0.887 . . . . 0.0 112.833 -177.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.453 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 3.1 tp-100 -86.46 -5.74 59.08 Favored 'General case' 0 N--CA 1.438 -1.052 0 C-N-CA 124.57 1.148 . . . . 0.0 111.71 -177.346 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.453 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 79.5 m-85 -138.2 159.78 66.77 Favored Pre-proline 0 N--CA 1.444 -0.747 0 C-N-CA 124.531 1.132 . . . . 0.0 111.261 -168.652 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -66.97 113.11 2.68 Favored 'Trans proline' 0 N--CA 1.454 -0.845 0 N-CA-C 105.159 -2.67 . . . . 0.0 105.159 165.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 39.6 mmtm -42.75 -35.62 1.2 Allowed 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 116.306 1.965 . . . . 0.0 116.306 -166.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.68 -15.86 20.56 Favored Glycine 0 CA--C 1.539 1.548 0 C-N-CA 124.629 1.109 . . . . 0.0 114.266 175.188 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.2 tpm_? -58.51 -24.22 59.99 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.745 2.018 . . . . 0.0 111.835 169.484 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 8.1 t -145.2 130.72 18.81 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-O 123.359 1.552 . . . . 0.0 112.787 -169.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.4 t -68.74 -50.71 52.62 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 CA-C-N 112.681 -2.054 . . . . 0.0 108.566 176.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.9 m -61.0 -45.37 98.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 CA-C-O 118.555 -0.735 . . . . 0.0 109.592 -178.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 24.4 t -61.65 -35.14 77.1 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.299 1.84 . . . . 0.0 110.304 178.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.6 m -66.96 -26.34 66.78 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.188 0.595 . . . . 0.0 111.303 172.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.84 -30.87 60.9 Favored Glycine 0 C--N 1.344 1.01 0 CA-C-O 123.437 1.576 . . . . 0.0 111.731 168.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.617 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 0.6 OUTLIER -81.36 -41.16 22.41 Favored 'General case' 0 N--CA 1.424 -1.733 0 N-CA-C 117.39 2.367 . . . . 0.0 117.39 -164.393 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 . . . . . 0 C--N 1.322 -0.623 0 CA-C-O 118.9 -0.571 . . . . 0.0 109.565 168.717 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.6 t0 . . . . . 0 CA--C 1.538 0.481 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -60.27 -32.9 94.86 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 123.747 2.965 . . . . 0.0 112.802 -171.208 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 96.3 m -94.14 -12.19 28.9 Favored 'General case' 0 N--CA 1.437 -1.099 0 C-N-CA 124.475 1.11 . . . . 0.0 113.144 -168.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 18.8 tp60 -61.38 -26.79 68.07 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 122.756 0.422 . . . . 0.0 110.833 177.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 51.9 tptt -60.05 -57.7 11.69 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.451 0.7 . . . . 0.0 109.807 168.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -60.28 -37.52 80.73 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 122.983 0.513 . . . . 0.0 110.317 -176.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -60.43 -35.82 76.73 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.465 1.106 . . . . 0.0 113.037 172.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 75.8 m -64.07 -44.49 92.23 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 118.343 0.52 . . . . 0.0 110.396 169.351 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.4 mm-40 -64.1 -25.09 67.95 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 117.955 -1.022 . . . . 0.0 112.28 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.418 HD13 HG13 ' A' ' 31' ' ' VAL . 46.8 mm -56.44 -50.5 72.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.243 0 CA-C-N 119.964 1.256 . . . . 0.0 109.409 169.251 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 -60.78 -55.39 33.74 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 -175.543 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 48.1 mttt -69.94 -30.58 68.0 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 118.245 -0.884 . . . . 0.0 111.425 -172.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 17.3 t -57.14 -46.76 82.42 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 168.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.05 -45.95 89.48 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 118.49 -0.767 . . . . 0.0 110.354 179.025 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -58.28 -45.27 88.21 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 119.177 0.899 . . . . 0.0 111.282 174.235 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.07 -13.53 58.21 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.048 0.939 . . . . 0.0 113.306 175.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -124.38 9.04 8.46 Favored 'General case' 0 C--N 1.343 0.289 0 C-N-CA 124.425 1.09 . . . . 0.0 112.351 -172.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.6 m 57.83 40.45 26.04 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 122.464 1.126 . . . . 0.0 110.814 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.256 6.8 m-85 72.01 13.98 5.84 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 127.852 2.461 . . . . 0.0 114.44 168.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 66.1 mtm -70.23 85.6 0.57 Allowed 'General case' 0 N--CA 1.44 -0.931 0 C-N-CA 125.132 1.373 . . . . 0.0 109.723 169.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -53.37 -25.69 16.45 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.312 0.645 . . . . 0.0 111.381 170.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.1 m -52.31 -38.86 59.62 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 126.744 2.018 . . . . 0.0 112.675 170.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.7 mmtm -74.17 -47.51 35.33 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.369 1.068 . . . . 0.0 108.69 173.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.2 m -71.71 0.89 7.72 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 124.892 1.277 . . . . 0.0 113.281 -174.496 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 51.6 mm-40 -54.72 -28.26 46.8 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 119.652 1.114 . . . . 0.0 110.242 166.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.59 -56.65 19.44 Favored 'General case' 0 C--N 1.346 0.441 0 C-N-CA 125.789 1.636 . . . . 0.0 111.906 171.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.418 HG13 HD13 ' A' ' 14' ' ' ILE . 13.4 p -75.77 -28.34 19.31 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.835 0 C-N-CA 123.288 0.635 . . . . 0.0 110.002 -174.113 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.478 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 60.0 mt -61.91 -45.85 97.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 N-CA-C 106.564 -1.643 . . . . 0.0 106.564 168.725 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.92 -38.41 70.24 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 119.202 0.91 . . . . 0.0 112.284 171.129 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -70.26 -37.85 74.98 Favored 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 119.354 -0.938 . . . . 0.0 110.085 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.551 HD13 ' CE1' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -65.28 -30.81 71.71 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 124.673 1.189 . . . . 0.0 108.834 174.957 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.0 mmt-85 -69.96 -49.89 47.31 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -61.02 -35.43 76.85 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-N 114.895 -1.048 . . . . 0.0 110.698 177.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 51.0 t -61.81 -57.17 12.89 Favored 'General case' 0 C--O 1.219 -0.551 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 168.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 35.4 t -58.39 -44.29 88.89 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 123.856 0.862 . . . . 0.0 112.144 -169.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.41 -1.21 10.01 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 124.03 0.932 . . . . 0.0 113.296 -178.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.555 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 15.5 tt0 -83.87 -8.85 59.1 Favored 'General case' 0 N--CA 1.444 -0.764 0 C-N-CA 124.435 1.094 . . . . 0.0 111.105 176.902 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.555 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 90.6 m-85 -138.97 158.02 70.49 Favored Pre-proline 0 N--CA 1.441 -0.894 0 C-N-CA 124.979 1.312 . . . . 0.0 112.106 -166.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -69.86 111.06 2.73 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 N-CA-C 104.968 -2.743 . . . . 0.0 104.968 165.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 64.3 pttt -42.01 -32.57 0.46 Allowed 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 117.964 2.579 . . . . 0.0 117.964 -166.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -56.47 -15.76 12.95 Favored Glycine 0 CA--C 1.538 1.509 0 CA-C-N 119.468 1.031 . . . . 0.0 114.177 172.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 5.0 tpm_? -54.05 -24.74 18.31 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 127.583 2.353 . . . . 0.0 112.132 168.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.3 t -146.76 137.74 24.05 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-O 122.73 1.252 . . . . 0.0 111.82 -170.392 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 18.7 t -66.84 -53.71 31.98 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.677 0 CA-C-N 113.491 -1.686 . . . . 0.0 108.487 177.172 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 3.8 m -60.26 -46.08 95.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-O 118.47 -0.776 . . . . 0.0 109.415 -178.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 41.9 t -63.31 -30.22 71.39 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.125 1.37 . . . . 0.0 109.943 -178.258 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 52.3 m -68.45 -27.48 66.21 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.186 0.595 . . . . 0.0 111.277 172.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -71.08 -40.42 61.98 Favored Glycine 0 N--CA 1.473 1.113 0 CA-C-O 124.781 2.323 . . . . 0.0 110.752 167.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.551 ' CE1' HD13 ' A' ' 35' ' ' LEU . 2.0 t80 -77.54 -35.88 52.87 Favored 'General case' 0 N--CA 1.41 -2.468 0 CA-C-N 111.22 -2.49 . . . . 0.0 116.677 -163.214 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 . . . . . 0 C--N 1.32 -0.711 0 CA-C-O 118.258 -0.877 . . . . 0.0 110.909 169.363 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.0 t0 . . . . . 0 CA--C 1.541 0.619 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_exo -54.97 -30.59 70.1 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 125.175 3.916 . . . . 0.0 113.639 -172.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 91.6 m -97.74 -11.87 22.93 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 125.83 1.652 . . . . 0.0 113.261 -169.026 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 23.1 tp60 -62.52 -26.83 68.76 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 118.194 0.452 . . . . 0.0 110.722 -178.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 51.5 tttm -58.4 -56.09 26.65 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 123.605 0.762 . . . . 0.0 110.497 169.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -62.73 -44.53 95.97 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.3 0.64 . . . . 0.0 109.667 -176.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -52.98 -38.76 62.49 Favored 'General case' 0 N--CA 1.462 0.171 0 C-N-CA 125.056 1.343 . . . . 0.0 113.218 173.012 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 66.4 m -60.03 -44.09 94.86 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 120.162 -0.615 . . . . 0.0 110.333 172.252 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -66.75 -27.59 67.73 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 117.324 -1.322 . . . . 0.0 113.196 -179.276 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.8 mp -55.88 -48.82 77.87 Favored 'Isoleucine or valine' 0 C--N 1.343 0.294 0 CA-C-N 121.037 1.744 . . . . 0.0 109.598 169.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -59.91 -55.98 27.41 Favored 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 24.3 mmtm -68.86 -31.56 70.61 Favored 'General case' 0 CA--C 1.522 -0.098 0 CA-C-O 118.527 -0.749 . . . . 0.0 112.004 -171.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 27.6 t -55.04 -47.01 75.34 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 169.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.54 -45.44 91.78 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-O 118.435 -0.793 . . . . 0.0 110.463 179.248 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -57.97 -46.56 84.95 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 119.261 0.937 . . . . 0.0 111.007 174.24 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.62 -14.86 59.86 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.044 0.937 . . . . 0.0 113.365 176.335 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 -120.8 8.34 10.55 Favored 'General case' 0 C--N 1.343 0.298 0 C-N-CA 124.334 1.054 . . . . 0.0 112.056 -174.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.5 m 57.56 40.75 26.64 Favored 'General case' 0 C--N 1.345 0.406 0 CA-C-O 122.511 1.148 . . . . 0.0 110.78 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.269 6.9 m-85 72.59 14.39 5.17 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 128.045 2.538 . . . . 0.0 114.48 168.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 69.5 mtm -70.08 82.39 0.5 Allowed 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 125.13 1.372 . . . . 0.0 109.941 169.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -52.97 -24.44 9.4 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.637 1.175 . . . . 0.0 111.164 169.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.0 m -51.4 -44.12 62.12 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 126.107 1.763 . . . . 0.0 112.201 169.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.3 mmtt -73.11 -47.77 41.44 Favored 'General case' 0 C--O 1.232 0.182 0 C-N-CA 124.634 1.174 . . . . 0.0 108.963 176.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.0 m -69.51 0.61 5.01 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 124.648 1.179 . . . . 0.0 113.073 -176.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 52.4 mm-40 -54.9 -30.27 57.91 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 119.887 1.221 . . . . 0.0 110.8 166.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.01 -54.79 43.12 Favored 'General case' 0 C--N 1.344 0.367 0 C-N-CA 124.702 1.201 . . . . 0.0 111.463 173.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.0 p -75.56 -31.02 22.63 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.727 0 C-N-CA 122.871 0.468 . . . . 0.0 110.405 -174.403 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.56 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 69.1 mt -59.03 -46.32 91.79 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 N-CA-C 106.345 -1.724 . . . . 0.0 106.345 168.649 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.71 -26.48 61.82 Favored 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 121.011 -1.056 . . . . 0.0 113.281 173.706 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -76.49 -37.76 56.32 Favored 'General case' 0 N--CA 1.432 -1.356 0 C-N-CA 119.846 -0.742 . . . . 0.0 110.277 175.16 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.497 ' HB3' ' CE2' ' A' ' 53' ' ' PHE . 2.8 mt -62.6 -32.37 73.36 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-O 117.778 -1.106 . . . . 0.0 109.514 169.5 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.5 mmt180 -62.79 -53.8 48.75 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 120.163 1.347 . . . . 0.0 108.195 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 54.6 mttp -64.2 -34.44 78.1 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.177 -178.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 47.5 t -63.25 -51.57 65.63 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 110.105 -0.332 . . . . 0.0 110.105 169.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 45.5 t -65.05 -47.77 76.2 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 124.673 1.189 . . . . 0.0 111.84 -169.065 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.93 -1.02 6.35 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 115.551 -0.75 . . . . 0.0 112.331 -175.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.563 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 12.0 tt0 -80.28 -11.66 59.7 Favored 'General case' 0 N--CA 1.443 -0.821 0 C-N-CA 125.94 1.696 . . . . 0.0 110.999 176.643 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.563 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 84.9 m-85 -136.42 158.03 74.21 Favored Pre-proline 0 N--CA 1.439 -0.99 0 C-N-CA 125.449 1.499 . . . . 0.0 111.243 -167.814 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -68.25 109.0 1.89 Allowed 'Trans proline' 0 N--CA 1.455 -0.771 0 N-CA-C 104.295 -3.002 . . . . 0.0 104.295 165.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.51 -36.49 0.39 Allowed 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 117.739 2.496 . . . . 0.0 117.739 -165.668 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.2 -14.72 12.42 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 124.55 1.071 . . . . 0.0 114.234 174.531 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 35.6 tpt85 -51.99 -33.2 37.12 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 126.986 2.114 . . . . 0.0 111.542 168.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.2 t -136.92 139.53 41.63 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-O 122.428 1.109 . . . . 0.0 110.625 -168.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 15.3 t -68.15 -54.08 24.71 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.695 0 CA-C-N 114.016 -1.447 . . . . 0.0 108.362 177.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 6.8 m -62.48 -42.42 95.67 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.119 -176.267 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 36.7 t -64.06 -32.37 73.89 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.634 1.574 . . . . 0.0 110.284 177.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.0 m -69.57 -26.04 64.28 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.83 -0.544 . . . . 0.0 111.131 171.348 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.91 -32.05 66.64 Favored Glycine 0 C--N 1.344 0.985 0 CA-C-O 123.427 1.571 . . . . 0.0 111.266 167.067 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.56 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 1.2 t80 -80.57 -43.23 20.97 Favored 'General case' 0 N--CA 1.417 -2.097 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 -164.206 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 25.6 mm-40 . . . . . 0 CA--C 1.542 0.637 0 C-N-CA 119.634 -0.826 . . . . 0.0 110.4 171.17 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 20.5 t0 . . . . . 0 N--CA 1.447 -0.588 0 N-CA-C 105.941 -1.874 . . . . 0.0 105.941 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -54.7 -34.75 85.13 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 124.497 3.465 . . . . 0.0 112.664 -170.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.401 ' HB3' ' CD2' ' A' ' 35' ' ' LEU . 77.5 m -94.48 -13.77 25.82 Favored 'General case' 0 N--CA 1.433 -1.319 0 C-N-CA 125.54 1.536 . . . . 0.0 113.03 -169.313 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 26.2 tp60 -61.85 -25.28 67.43 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 118.754 0.707 . . . . 0.0 111.224 -179.136 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 51.8 tttm -59.53 -56.62 19.71 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.766 1.226 . . . . 0.0 110.166 169.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -63.61 -38.23 90.34 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.73 0.812 . . . . 0.0 110.203 -177.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.99 -42.17 72.14 Favored 'General case' 0 C--N 1.339 0.148 0 C-N-CA 124.901 1.28 . . . . 0.0 112.816 171.18 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 82.0 m -57.56 -46.48 83.89 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.29 172.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -62.99 -25.44 68.38 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 117.84 -1.076 . . . . 0.0 112.253 -178.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.408 HD13 HG13 ' A' ' 31' ' ' VAL . 34.6 mm -57.15 -54.47 29.98 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.378 0 CA-C-N 120.019 1.281 . . . . 0.0 109.235 172.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 36.7 mm-40 -58.18 -54.47 46.65 Favored 'General case' 0 N--CA 1.443 -0.816 0 O-C-N 124.18 0.925 . . . . 0.0 108.934 -178.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -66.5 -32.68 74.18 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 118.925 -1.11 . . . . 0.0 111.693 -175.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 25.2 t -56.2 -48.89 75.53 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 119.443 1.02 . . . . 0.0 108.902 169.397 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.73 -46.8 86.55 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 123.244 0.618 . . . . 0.0 110.487 179.826 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -57.11 -45.92 83.04 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.977 0.911 . . . . 0.0 111.199 174.35 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.54 -12.4 52.5 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.18 0.992 . . . . 0.0 113.424 175.3 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 52.2 m-80 -124.67 8.83 8.27 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.688 1.195 . . . . 0.0 112.187 -173.13 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.1 m 57.93 40.31 25.85 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.646 1.112 . . . . 0.0 110.979 179.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.265 6.9 m-85 72.17 14.05 5.66 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 127.817 2.447 . . . . 0.0 114.619 168.846 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 64.5 mtm -69.47 86.52 0.44 Allowed 'General case' 0 N--CA 1.44 -0.964 0 C-N-CA 125.127 1.371 . . . . 0.0 109.962 169.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -53.5 -26.12 19.42 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.252 1.021 . . . . 0.0 111.21 169.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.5 m -57.05 -32.13 65.89 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 127.497 2.319 . . . . 0.0 113.514 170.541 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.5 mmtm -79.62 -45.55 18.89 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.251 1.02 . . . . 0.0 108.769 171.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 81.2 m -73.88 9.0 1.67 Allowed 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 125.675 1.59 . . . . 0.0 113.709 -175.117 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 59.9 mm-40 -53.16 -38.14 62.48 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.425 -0.797 . . . . 0.0 110.737 168.049 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.31 -50.11 74.94 Favored 'General case' 0 C--N 1.342 0.242 0 C-N-CA 123.666 0.786 . . . . 0.0 111.631 178.21 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.408 HG13 HD13 ' A' ' 14' ' ' ILE . 8.7 p -75.13 -28.4 20.68 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.841 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.741 -175.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.482 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 55.4 mt -61.19 -50.14 81.72 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.637 0 N-CA-C 106.852 -1.536 . . . . 0.0 106.852 169.003 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -55.23 -27.81 48.83 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 123.819 0.848 . . . . 0.0 111.139 176.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -74.66 -43.29 56.02 Favored 'General case' 0 N--CA 1.441 -0.91 0 O-C-N 121.75 -0.594 . . . . 0.0 112.421 174.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.435 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 2.6 mt -62.14 -30.38 71.0 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 119.393 0.997 . . . . 0.0 110.547 170.417 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.9 ttt-85 -64.78 -58.88 5.04 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 126.433 1.893 . . . . 0.0 110.155 178.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.7 ptmt -65.94 -27.98 68.57 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.796 -179.489 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 47.7 t -65.76 -51.44 59.16 Favored 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 168.422 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.1 t -62.9 -48.78 77.49 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.435 0.694 . . . . 0.0 112.186 -169.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.48 -2.81 5.07 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 124.176 0.99 . . . . 0.0 112.608 -176.39 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.559 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 14.2 tt0 -79.26 -12.15 59.95 Favored 'General case' 0 N--CA 1.441 -0.883 0 C-N-CA 125.57 1.548 . . . . 0.0 111.032 175.677 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.559 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 83.9 m-85 -135.31 159.22 72.6 Favored Pre-proline 0 N--CA 1.442 -0.833 0 C-N-CA 125.032 1.333 . . . . 0.0 111.801 -167.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -69.19 115.14 3.87 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 N-CA-C 104.926 -2.759 . . . . 0.0 104.926 165.157 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.485 ' H ' ' HE2' ' A' ' 44' ' ' LYS . 0.3 OUTLIER -38.6 -44.39 0.97 Allowed 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 116.234 1.939 . . . . 0.0 116.234 -166.417 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -56.89 -12.36 6.87 Favored Glycine 0 CA--C 1.535 1.327 0 C-N-CA 124.842 1.21 . . . . 0.0 114.328 178.105 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 34.8 tpt85 -54.28 -34.24 60.4 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 127.01 2.124 . . . . 0.0 111.91 169.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.5 t -143.23 142.13 31.3 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 122.344 1.068 . . . . 0.0 111.055 -168.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 6.5 t -70.03 -56.39 11.45 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 CA-C-N 114.257 -1.338 . . . . 0.0 108.84 -179.01 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.2 m -60.23 -37.56 74.06 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 122.927 0.491 . . . . 0.0 110.581 -177.037 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . 0.452 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 8.1 t -69.37 -38.29 77.97 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.278 1.031 . . . . 0.0 109.919 177.663 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 44.5 m -65.04 -27.07 68.55 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.605 -0.685 . . . . 0.0 110.506 171.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.61 -25.61 75.42 Favored Glycine 0 C--N 1.343 0.959 0 CA-C-O 121.455 0.475 . . . . 0.0 112.5 169.66 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.482 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 0.3 OUTLIER -80.69 -46.42 15.58 Favored 'General case' 0 N--CA 1.431 -1.412 0 N-CA-C 115.449 1.648 . . . . 0.0 115.449 -165.489 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 . . . . . 0 N--CA 1.444 -0.733 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.925 173.936 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 18.1 t0 . . . . . 0 N--CA 1.448 -0.551 0 N-CA-C 108.185 -1.042 . . . . 0.0 108.185 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -56.84 -34.48 96.86 Favored 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 123.979 3.119 . . . . 0.0 112.699 -170.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 69.2 m -94.24 -13.06 26.97 Favored 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 125.134 1.374 . . . . 0.0 112.914 -169.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 33.3 tp60 -62.72 -25.81 68.36 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 118.614 0.643 . . . . 0.0 110.827 179.206 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 50.7 tptt -60.11 -54.49 45.3 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 123.336 0.654 . . . . 0.0 110.21 169.238 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -62.98 -38.99 93.38 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.382 0.673 . . . . 0.0 109.907 -177.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -55.35 -45.02 76.48 Favored 'General case' 0 CA--C 1.518 -0.288 0 C-N-CA 124.954 1.302 . . . . 0.0 112.406 169.585 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 62.6 m -59.09 -40.34 85.0 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 118.119 0.418 . . . . 0.0 111.337 173.208 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -65.4 -21.52 66.68 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-O 117.776 -1.107 . . . . 0.0 112.679 176.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.431 HD13 HG13 ' A' ' 31' ' ' VAL . 28.0 mm -60.26 -50.37 80.51 Favored 'Isoleucine or valine' 0 C--N 1.342 0.28 0 CA-C-N 120.532 1.514 . . . . 0.0 109.388 171.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -58.75 -57.08 14.58 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 107.409 -1.33 . . . . 0.0 107.409 179.618 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 42.0 mtpt -68.35 -29.43 68.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 118.597 -0.716 . . . . 0.0 111.701 -169.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.402 ' CB ' HG11 ' A' ' 31' ' ' VAL . 25.7 t -56.15 -47.56 77.96 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 118.889 0.768 . . . . 0.0 109.186 169.024 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.41 -44.86 89.22 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 118.662 -0.685 . . . . 0.0 111.086 178.748 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.471 ' HA ' ' CE1' ' A' ' 23' ' ' TYR . 3.0 mp0 -58.37 -43.49 88.48 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 118.214 0.461 . . . . 0.0 111.428 173.665 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.99 -12.44 61.61 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 114.189 1.181 . . . . 0.0 114.189 176.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -125.87 15.01 8.02 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 119.673 1.124 . . . . 0.0 113.789 -168.817 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 18.1 m 60.56 35.1 20.16 Favored 'General case' 0 C--N 1.346 0.414 0 CA-C-N 120.619 1.554 . . . . 0.0 110.067 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.471 ' CE1' ' HA ' ' A' ' 19' ' ' GLN . 38.0 m-85 68.18 14.83 9.33 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 126.588 1.955 . . . . 0.0 113.737 167.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 62.9 mtm -74.54 89.72 2.2 Favored 'General case' 0 N--CA 1.439 -1.021 0 C-N-CA 126.048 1.739 . . . . 0.0 108.903 175.553 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -55.42 -23.77 26.74 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 119.165 -0.445 . . . . 0.0 111.405 172.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.4 m -52.33 -44.69 65.3 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 126.424 1.89 . . . . 0.0 112.098 170.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 62.8 mmtt -67.32 -47.65 69.9 Favored 'General case' 0 C--N 1.341 0.205 0 C-N-CA 123.832 0.853 . . . . 0.0 108.959 174.044 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.425 ' O ' HG12 ' A' ' 31' ' ' VAL . 71.8 m -71.31 0.61 7.66 Favored 'General case' 0 N--CA 1.443 -0.791 0 C-N-CA 124.455 1.102 . . . . 0.0 112.945 -174.181 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 -56.59 -25.71 53.48 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 120.042 1.292 . . . . 0.0 111.101 167.186 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.06 -49.43 76.94 Favored 'General case' 0 C--N 1.345 0.381 0 C-N-CA 125.648 1.579 . . . . 0.0 112.174 169.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.431 HG13 HD13 ' A' ' 14' ' ' ILE . 7.4 p -82.67 -26.5 8.45 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.877 0 C-N-CA 123.917 0.887 . . . . 0.0 109.88 -174.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.5 mp -59.39 -47.06 91.95 Favored 'Isoleucine or valine' 0 C--N 1.348 0.541 0 N-CA-C 105.476 -2.046 . . . . 0.0 105.476 165.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.14 -32.53 62.16 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 123.12 0.568 . . . . 0.0 112.002 175.372 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -74.92 -39.88 61.17 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 119.951 -0.7 . . . . 0.0 111.463 178.361 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.496 HD13 ' CE1' ' A' ' 53' ' ' PHE . 1.6 mt -63.6 -35.48 80.65 Favored 'General case' 0 C--N 1.342 0.248 0 CA-C-N 119.217 0.917 . . . . 0.0 110.097 173.57 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.07 -60.46 3.46 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 125.104 1.361 . . . . 0.0 109.592 174.357 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -59.95 -38.54 82.77 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 113.728 -1.578 . . . . 0.0 110.235 -176.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 52.3 t -60.44 -52.06 66.84 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 122.937 0.495 . . . . 0.0 109.678 171.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 38.1 t -60.15 -43.36 95.82 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 121.09 0.472 . . . . 0.0 111.323 -172.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.04 -2.03 6.95 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 125.383 1.473 . . . . 0.0 113.378 179.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.556 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 23.3 tt0 -80.46 -8.81 59.69 Favored 'General case' 0 N--CA 1.442 -0.84 0 C-N-CA 123.882 0.873 . . . . 0.0 110.523 171.809 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.556 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 84.6 m-85 -141.07 167.12 18.37 Favored Pre-proline 0 N--CA 1.444 -0.765 0 C-N-CA 125.659 1.584 . . . . 0.0 111.458 -167.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -66.24 139.42 55.03 Favored 'Trans proline' 0 CA--C 1.538 0.698 0 N-CA-C 106.633 -2.103 . . . . 0.0 106.633 164.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.9 ptpp? -57.92 -26.69 62.55 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 115.115 1.524 . . . . 0.0 115.115 -168.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -80.69 0.62 85.66 Favored Glycine 0 CA--C 1.531 1.07 0 C-N-CA 124.24 0.924 . . . . 0.0 113.817 177.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 46.0 tpt85 -58.13 -35.97 72.27 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-N 119.368 1.584 . . . . 0.0 112.623 179.217 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -141.14 151.36 43.83 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 124.832 1.253 . . . . 0.0 110.038 -166.258 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 8.8 t -69.02 -56.68 11.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 123.938 0.895 . . . . 0.0 109.259 -177.37 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 9.2 m -59.73 -38.96 78.34 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 C-N-CA 122.954 0.502 . . . . 0.0 109.982 -179.09 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . 0.477 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 11.2 t -68.39 -35.37 77.59 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.349 1.06 . . . . 0.0 109.837 179.374 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 48.9 m -64.36 -28.15 69.5 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 121.744 -0.598 . . . . 0.0 110.592 172.491 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -74.38 -25.14 71.28 Favored Glycine 0 C--N 1.344 1.012 0 CA-C-O 121.981 0.767 . . . . 0.0 111.809 172.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.496 ' CE1' HD13 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -81.9 -50.25 9.39 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.944 1.698 . . . . 0.0 114.447 -167.805 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 . . . . . 0 N--CA 1.443 -0.824 0 CA-C-N 115.591 -0.732 . . . . 0.0 110.434 174.18 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.6 t0 . . . . . 0 N--CA 1.448 -0.572 0 N-CA-C 102.92 -2.993 . . . . 0.0 102.92 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -66.79 -35.88 26.03 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 123.555 2.837 . . . . 0.0 112.219 -169.494 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 87.5 m -94.77 -13.65 25.45 Favored 'General case' 0 N--CA 1.436 -1.155 0 C-N-CA 124.006 0.922 . . . . 0.0 113.45 -167.349 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.472 ' HA ' HG11 ' A' ' 49' ' ' VAL . 1.9 tm0? -51.21 -37.49 47.05 Favored 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 125.289 1.436 . . . . 0.0 111.489 171.899 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -57.23 -58.76 6.8 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 125.323 1.449 . . . . 0.0 110.039 171.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -62.39 -36.93 83.85 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.271 0.628 . . . . 0.0 110.774 -176.329 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -57.95 -38.91 76.84 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.617 1.167 . . . . 0.0 112.172 172.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 75.5 m -61.36 -43.06 99.51 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 118.399 0.545 . . . . 0.0 110.718 172.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -63.79 -22.33 66.86 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 117.95 -1.024 . . . . 0.0 112.328 178.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 23.9 mm -60.51 -53.7 45.28 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.334 0 CA-C-N 120.291 1.405 . . . . 0.0 109.277 171.571 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 16.8 mm-40 -61.35 -52.34 65.05 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 -178.239 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 40.7 mtpt -68.13 -30.75 69.97 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 118.29 -0.862 . . . . 0.0 111.354 -174.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 14.1 t -58.01 -47.94 81.53 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-N 119.298 0.954 . . . . 0.0 108.444 168.36 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.7 -47.02 83.55 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.287 0.635 . . . . 0.0 110.384 179.068 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -57.46 -44.9 85.19 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.918 0.887 . . . . 0.0 111.193 174.119 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.58 -12.76 59.37 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 175.016 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 47.9 m-80 -124.37 8.63 8.44 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 124.584 1.154 . . . . 0.0 112.308 -172.46 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 58.61 40.11 23.92 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 122.367 1.08 . . . . 0.0 110.915 179.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.258 7.1 m-85 71.98 13.98 5.87 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 127.883 2.473 . . . . 0.0 114.619 168.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 68.3 mtm -70.63 83.93 0.62 Allowed 'General case' 0 N--CA 1.443 -0.821 0 C-N-CA 125.128 1.371 . . . . 0.0 109.695 170.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -54.4 -23.26 15.03 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.687 0.795 . . . . 0.0 111.722 172.283 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.6 m -53.03 -40.87 64.21 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 126.013 1.725 . . . . 0.0 112.273 170.047 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 50.6 mmtt -70.81 -47.69 58.13 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 124.31 1.044 . . . . 0.0 108.809 174.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.6 m -73.12 1.37 9.25 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 124.711 1.205 . . . . 0.0 113.267 -173.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 76.0 mm-40 -54.41 -31.08 54.31 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 119.485 1.039 . . . . 0.0 110.488 167.242 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.69 -58.23 8.69 Favored 'General case' 0 C--N 1.345 0.39 0 C-N-CA 124.884 1.274 . . . . 0.0 111.463 174.096 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.8 p -74.6 -28.99 22.77 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.91 0 C-N-CA 123.981 0.913 . . . . 0.0 109.995 -173.243 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.469 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 58.1 mt -59.52 -48.99 85.29 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 N-CA-C 105.943 -1.873 . . . . 0.0 105.943 168.043 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.5 ' HA ' ' HG3' ' A' ' 36' ' ' ARG . 0.7 OUTLIER -61.1 -31.6 71.28 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 119.325 0.966 . . . . 0.0 113.097 175.572 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -68.49 -39.92 81.14 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 119.433 1.015 . . . . 0.0 110.089 175.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.52 HD13 ' CE1' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -63.33 -29.05 70.43 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 124.648 1.179 . . . . 0.0 108.774 176.037 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.5 ' HG3' ' HA ' ' A' ' 33' ' ' GLN . 10.3 mmt85 -69.68 -50.44 43.85 Favored 'General case' 0 CA--C 1.512 -0.505 0 CA-C-N 119.203 0.91 . . . . 0.0 108.556 -179.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 62.9 mmtt -63.07 -32.84 74.3 Favored 'General case' 0 C--O 1.235 0.296 0 O-C-N 123.849 0.718 . . . . 0.0 111.069 178.735 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.2 t -62.5 -54.59 37.71 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 169.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 46.5 t -62.88 -47.95 81.11 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 124.058 0.943 . . . . 0.0 111.936 -169.694 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.26 -0.95 5.28 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 124.59 1.156 . . . . 0.0 112.609 -177.467 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.51 ' HB3' ' CE2' ' A' ' 42' ' ' TYR . 2.1 tp-100 -79.13 -11.69 59.98 Favored 'General case' 0 N--CA 1.438 -1.073 0 C-N-CA 123.767 0.827 . . . . 0.0 111.463 172.106 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.51 ' CE2' ' HB3' ' A' ' 41' ' ' GLN . 68.0 m-85 -137.27 156.66 75.21 Favored Pre-proline 0 N--CA 1.443 -0.812 0 C-N-CA 123.972 0.909 . . . . 0.0 112.151 -167.146 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.8 121.5 8.56 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 N-CA-C 105.645 -2.483 . . . . 0.0 105.645 166.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -44.5 -40.52 5.67 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 116.306 1.965 . . . . 0.0 116.306 -166.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.44 -13.78 31.61 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 123.783 0.706 . . . . 0.0 113.657 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.06 -21.19 66.0 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.859 1.263 . . . . 0.0 112.449 171.093 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.8 t -142.84 137.03 29.33 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-O 122.988 1.375 . . . . 0.0 111.107 -176.44 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 19.3 t -66.98 -53.45 33.93 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.615 0 CA-C-N 113.852 -1.522 . . . . 0.0 108.926 -178.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.472 HG11 ' HA ' ' A' ' 8' ' ' GLN . 2.4 m -59.81 -46.65 93.45 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 -178.761 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 42.2 t -63.0 -30.65 71.77 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.952 1.301 . . . . 0.0 109.924 -176.678 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 64.5 m -68.0 -24.81 65.17 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 118.663 -0.684 . . . . 0.0 111.893 174.073 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -74.08 -40.22 43.31 Favored Glycine 0 N--CA 1.471 1.001 0 CA-C-O 124.288 2.049 . . . . 0.0 111.193 167.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.52 ' CE1' HD13 ' A' ' 35' ' ' LEU . 2.0 t80 -76.63 -37.67 55.97 Favored 'General case' 0 N--CA 1.411 -2.395 0 CA-C-N 111.055 -2.573 . . . . 0.0 116.848 -162.545 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 . . . . . 0 N--CA 1.449 -0.501 0 C-N-CA 119.651 -0.82 . . . . 0.0 110.766 169.846 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.0 t0 . . . . . 0 CA--C 1.536 0.417 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -51.62 -36.37 60.49 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 124.48 3.453 . . . . 0.0 112.37 -169.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 95.4 m -92.97 -8.73 42.25 Favored 'General case' 0 N--CA 1.436 -1.156 0 C-N-CA 126.538 1.935 . . . . 0.0 113.279 -169.152 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 29.4 tp60 -62.89 -24.97 68.08 Favored 'General case' 0 N--CA 1.446 -0.655 0 O-C-N 121.596 -0.69 . . . . 0.0 110.659 178.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -57.63 -56.78 17.52 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 123.424 0.689 . . . . 0.0 109.594 168.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 20.2 mp0 -59.06 -43.39 91.71 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 123.646 0.778 . . . . 0.0 110.203 -177.654 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.23 -44.11 71.44 Favored 'General case' 0 C--N 1.339 0.133 0 C-N-CA 124.404 1.081 . . . . 0.0 112.209 174.052 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 97.4 m -60.55 -45.64 93.14 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 117.498 0.135 . . . . 0.0 110.915 172.101 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 61.0 mm-40 -63.16 -23.65 67.53 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 117.577 -1.202 . . . . 0.0 112.745 178.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 43.7 mm -57.05 -54.16 33.76 Favored 'Isoleucine or valine' 0 C--N 1.342 0.254 0 CA-C-N 120.659 1.572 . . . . 0.0 109.233 172.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 34.7 mm-40 -58.75 -54.01 51.88 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 124.02 0.825 . . . . 0.0 109.086 -179.205 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.2 mptp? -66.81 -32.21 73.35 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 118.944 -1.102 . . . . 0.0 111.709 -174.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 24.7 t -56.42 -48.35 77.15 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 119.381 0.991 . . . . 0.0 108.841 169.029 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.32 -46.8 85.49 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 123.216 0.606 . . . . 0.0 110.628 179.297 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -56.97 -45.58 82.78 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.739 0.816 . . . . 0.0 111.205 174.021 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.95 -12.57 55.83 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.027 0.931 . . . . 0.0 113.437 175.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.7 m-80 -124.31 8.68 8.48 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.617 1.167 . . . . 0.0 112.228 -173.164 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 58.32 40.19 24.75 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 122.426 1.108 . . . . 0.0 110.913 179.619 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.255 6.9 m-85 71.98 13.64 5.92 Favored 'General case' 0 N--CA 1.445 -0.701 0 C-N-CA 127.817 2.447 . . . . 0.0 114.619 168.865 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 67.2 mtm -71.01 83.72 0.69 Allowed 'General case' 0 N--CA 1.44 -0.942 0 C-N-CA 125.144 1.378 . . . . 0.0 109.474 170.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -55.89 -22.11 23.9 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.949 0.9 . . . . 0.0 111.973 173.602 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 7.0 m -56.99 -34.18 67.87 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 126.728 2.011 . . . . 0.0 113.086 169.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 52.4 mmtt -74.89 -46.2 37.66 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 124.052 0.941 . . . . 0.0 108.74 171.813 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.3 m -73.73 6.13 3.45 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 125.133 1.373 . . . . 0.0 113.191 -174.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 40.0 mm-40 -54.93 -31.87 60.72 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 119.182 0.901 . . . . 0.0 110.139 167.138 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.33 -56.86 16.41 Favored 'General case' 0 C--N 1.345 0.391 0 C-N-CA 125.117 1.367 . . . . 0.0 111.433 174.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.7 p -73.69 -27.71 23.45 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 C-N-CA 123.843 0.857 . . . . 0.0 110.083 -174.308 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.546 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 63.6 mt -61.03 -49.53 84.34 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 N-CA-C 106.605 -1.628 . . . . 0.0 106.605 168.135 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -55.98 -30.84 62.37 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 118.915 0.78 . . . . 0.0 111.849 174.318 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -69.14 -46.19 68.24 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 118.862 0.756 . . . . 0.0 111.632 173.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.494 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.5 mt -55.74 -34.03 64.81 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-N 119.005 0.821 . . . . 0.0 109.577 172.384 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -70.39 -54.72 11.3 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 125.086 1.355 . . . . 0.0 111.648 -176.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 62.3 mttm -61.45 -34.7 75.88 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 124.728 1.211 . . . . 0.0 110.779 176.425 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 50.8 t -63.82 -51.01 66.65 Favored 'General case' 0 N--CA 1.444 -0.77 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 169.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 53.9 t -61.77 -50.07 73.82 Favored 'General case' 0 CA--C 1.515 -0.379 0 C-N-CA 123.446 0.698 . . . . 0.0 112.084 -172.029 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.51 -1.8 5.53 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 124.629 1.172 . . . . 0.0 111.98 -176.139 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.48 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 2.3 tp-100 -79.64 -8.12 58.99 Favored 'General case' 0 N--CA 1.438 -1.042 0 C-N-CA 124.589 1.156 . . . . 0.0 111.123 174.2 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.48 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 79.2 m-85 -141.6 163.1 43.23 Favored Pre-proline 0 N--CA 1.441 -0.913 0 C-N-CA 125.446 1.498 . . . . 0.0 111.024 -168.264 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -67.81 135.46 35.54 Favored 'Trans proline' 0 CA--C 1.537 0.638 0 N-CA-C 106.35 -2.212 . . . . 0.0 106.35 165.658 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -55.1 -29.47 57.7 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 114.889 1.44 . . . . 0.0 114.889 -168.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -67.86 -9.17 55.78 Favored Glycine 0 CA--C 1.533 1.201 0 CA-C-O 119.062 -0.855 . . . . 0.0 113.922 177.278 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 41.4 tpt85 -60.89 -31.97 71.44 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 119.171 1.486 . . . . 0.0 112.221 175.207 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.4 t -144.79 138.19 26.94 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 123.538 0.735 . . . . 0.0 110.273 -168.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 11.0 t -63.59 -56.75 15.15 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 CA-C-N 114.748 -1.115 . . . . 0.0 108.743 -178.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.2 m -59.01 -40.7 81.28 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 123.571 0.748 . . . . 0.0 110.438 -176.281 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . 0.412 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 6.9 t -66.64 -37.84 85.67 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.82 1.248 . . . . 0.0 109.648 179.016 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 27.1 p -65.56 -25.07 67.26 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 121.788 -0.57 . . . . 0.0 111.051 174.207 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.89 -26.77 68.26 Favored Glycine 0 C--N 1.346 1.095 0 CA-C-O 121.759 0.644 . . . . 0.0 112.423 170.049 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.546 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 0.4 OUTLIER -80.43 -46.51 15.84 Favored 'General case' 0 N--CA 1.429 -1.523 0 N-CA-C 116.043 1.868 . . . . 0.0 116.043 -164.641 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 71.2 mt-10 . . . . . 0 CA--C 1.542 0.657 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.54 172.291 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.4 t0 . . . . . 0 N--CA 1.446 -0.667 0 N-CA-C 106.288 -1.745 . . . . 0.0 106.288 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -60.18 -37.23 84.9 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 123.211 2.607 . . . . 0.0 111.964 -171.229 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 93.5 m -92.01 -9.51 42.61 Favored 'General case' 0 N--CA 1.443 -0.791 0 C-N-CA 125.189 1.396 . . . . 0.0 113.047 -167.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 20.1 tp60 -59.53 -25.51 64.57 Favored 'General case' 0 N--CA 1.439 -0.993 0 CA-C-O 118.99 -0.529 . . . . 0.0 110.063 172.087 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 56.5 tptt -56.35 -61.68 2.24 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.895 1.278 . . . . 0.0 109.122 167.439 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 19.5 mp0 -57.91 -42.34 84.54 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 118.826 -0.607 . . . . 0.0 110.36 -177.431 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -56.56 -40.52 75.32 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.495 1.118 . . . . 0.0 112.388 174.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 96.6 m -64.63 -45.01 88.67 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 123.338 0.655 . . . . 0.0 111.27 170.234 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -63.76 -26.33 68.59 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-O 117.434 -1.269 . . . . 0.0 111.958 -179.299 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.601 HD13 HG22 ' A' ' 31' ' ' VAL . 12.1 mm -57.06 -50.11 77.42 Favored 'Isoleucine or valine' 0 C--N 1.34 0.192 0 CA-C-N 120.439 1.472 . . . . 0.0 109.036 170.311 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 47.2 mm-40 -60.18 -49.54 77.24 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 -174.127 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 26.8 mttp -71.71 -37.51 70.64 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 124.272 1.029 . . . . 0.0 111.943 -176.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 11.3 t -53.23 -43.34 67.21 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 108.463 -0.939 . . . . 0.0 108.463 169.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.01 -45.61 90.26 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 -178.075 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.414 ' HA ' ' CE1' ' A' ' 23' ' ' TYR . 5.1 mm-40 -64.57 -41.78 96.06 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 123.852 0.861 . . . . 0.0 110.521 179.11 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.22 -11.93 17.44 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.172 0.804 . . . . 0.0 113.172 171.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 55.4 m-80 -126.32 9.65 7.3 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.067 1.347 . . . . 0.0 112.257 -175.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 12.6 m 54.48 42.01 31.61 Favored 'General case' 0 C--N 1.345 0.389 0 CA-C-O 122.68 1.229 . . . . 0.0 111.983 -178.16 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.414 ' CE1' ' HA ' ' A' ' 19' ' ' GLN 0.264 7.3 m-85 73.36 13.45 4.61 Favored 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 128.523 2.729 . . . . 0.0 114.526 168.046 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 66.7 mtm -69.6 85.02 0.44 Allowed 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 125.121 1.368 . . . . 0.0 109.761 169.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -54.46 -23.65 16.99 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.376 0.671 . . . . 0.0 111.538 171.09 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.1 m -52.73 -41.29 63.84 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 126.161 1.784 . . . . 0.0 112.151 170.082 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.3 mmtm -71.85 -47.8 50.54 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.28 1.032 . . . . 0.0 108.926 175.034 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.3 m -70.95 1.0 6.16 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 124.679 1.191 . . . . 0.0 112.919 -175.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 74.0 mm-40 -55.45 -29.53 58.84 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 119.635 1.107 . . . . 0.0 110.131 166.37 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.29 -59.25 5.21 Favored 'General case' 0 C--N 1.345 0.378 0 C-N-CA 124.946 1.298 . . . . 0.0 111.371 173.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.601 HG22 HD13 ' A' ' 14' ' ' ILE . 14.9 p -72.46 -29.15 30.18 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.819 0 C-N-CA 124.057 0.943 . . . . 0.0 109.909 -174.418 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 60.9 mt -60.69 -48.53 88.32 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 N-CA-C 106.263 -1.754 . . . . 0.0 106.263 169.077 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.407 ' HA ' ' HG3' ' A' ' 36' ' ' ARG . 0.9 OUTLIER -61.6 -28.99 69.75 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 119.637 1.108 . . . . 0.0 113.224 174.192 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 46.4 tt0 -67.11 -39.18 86.65 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 119.419 1.009 . . . . 0.0 109.973 172.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.532 HD13 ' CE1' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -60.07 -30.48 69.25 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 125.726 1.61 . . . . 0.0 109.084 175.294 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.407 ' HG3' ' HA ' ' A' ' 33' ' ' GLN . 18.9 mmt85 -71.89 -50.94 24.91 Favored 'General case' 0 C--N 1.343 0.292 0 C-N-CA 123.982 0.913 . . . . 0.0 108.567 -179.427 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -63.51 -29.78 71.0 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 124.755 1.222 . . . . 0.0 111.224 178.358 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 51.7 t -67.96 -55.44 12.73 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 167.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 44.3 t -59.61 -44.32 93.45 Favored 'General case' 0 C--N 1.328 -0.336 0 O-C-N 121.107 -0.995 . . . . 0.0 112.904 -170.253 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.25 -0.67 10.45 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 113.216 0.821 . . . . 0.0 113.216 -174.355 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.557 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 13.2 tt0 -93.62 -9.31 38.41 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 126.891 2.076 . . . . 0.0 111.914 -169.695 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.557 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 81.2 m-85 -133.84 163.08 53.72 Favored Pre-proline 0 N--CA 1.448 -0.537 0 C-N-CA 124.681 1.193 . . . . 0.0 111.625 -167.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -68.84 94.26 0.45 Allowed 'Trans proline' 0 N--CA 1.456 -0.723 0 N-CA-C 104.743 -2.83 . . . . 0.0 104.743 164.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.512 ' H ' ' HD2' ' A' ' 44' ' ' LYS . 2.7 mptp? -39.08 -28.74 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 128.498 2.719 . . . . 0.0 117.898 -164.803 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -56.27 -17.11 16.82 Favored Glycine 0 CA--C 1.54 1.636 0 CA-C-N 120.033 1.288 . . . . 0.0 113.597 169.162 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -54.4 -24.1 18.47 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 127.965 2.506 . . . . 0.0 111.52 168.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.6 t -140.5 132.26 27.4 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-O 123.355 1.55 . . . . 0.0 113.33 -172.344 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 20.9 t -70.54 -52.23 30.8 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.717 0 CA-C-N 112.723 -2.035 . . . . 0.0 108.887 176.548 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.9 m -59.38 -45.49 93.39 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 CA-C-O 118.828 -0.606 . . . . 0.0 109.542 -179.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 35.1 t -62.88 -33.27 74.94 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.684 1.594 . . . . 0.0 109.953 -179.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 54.4 m -66.39 -25.19 66.66 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.24 0.616 . . . . 0.0 111.391 173.043 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.38 -47.57 28.22 Favored Glycine 0 N--CA 1.473 1.163 0 CA-C-O 124.527 2.182 . . . . 0.0 109.638 166.588 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.532 ' CE1' HD13 ' A' ' 35' ' ' LEU . 1.6 t80 -66.58 -36.6 83.02 Favored 'General case' 0 N--CA 1.408 -2.528 0 CA-C-N 110.917 -2.642 . . . . 0.0 116.325 -164.659 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 . . . . . 0 C--N 1.32 -0.681 0 CA-C-O 118.281 -0.866 . . . . 0.0 111.634 173.688 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.3 t0 . . . . . 0 CA--C 1.536 0.428 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -55.9 -29.85 74.73 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 124.54 3.493 . . . . 0.0 113.325 -171.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.419 ' HB3' ' CD2' ' A' ' 35' ' ' LEU . 88.7 m -96.78 -12.62 23.42 Favored 'General case' 0 N--CA 1.433 -1.28 0 C-N-CA 125.922 1.689 . . . . 0.0 113.905 -168.504 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 18.9 tp60 -62.02 -24.7 67.22 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 117.98 0.355 . . . . 0.0 111.627 -176.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.4 ttpp -70.88 -45.86 63.63 Favored 'General case' 0 CA--C 1.532 0.275 0 O-C-N 121.522 -0.736 . . . . 0.0 111.043 173.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -63.26 -40.36 97.19 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.458 0.703 . . . . 0.0 109.892 178.78 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -53.15 -40.51 64.32 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 124.631 1.172 . . . . 0.0 113.046 169.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 72.2 m -58.71 -46.05 88.18 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 110.443 -0.206 . . . . 0.0 110.443 174.022 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -60.93 -27.9 68.55 Favored 'General case' 0 CA--C 1.528 0.127 0 CA-C-O 118.112 -0.947 . . . . 0.0 112.691 178.437 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 21.8 mm -57.92 -54.32 33.49 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.473 0 CA-C-N 119.444 1.02 . . . . 0.0 109.339 173.522 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 36.0 mm-40 -58.15 -55.14 38.78 Favored 'General case' 0 N--CA 1.444 -0.764 0 O-C-N 124.365 1.041 . . . . 0.0 108.864 -177.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.65 -32.96 74.62 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 118.209 -1.396 . . . . 0.0 112.045 -175.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 31.0 t -56.46 -47.5 79.04 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 119.483 1.038 . . . . 0.0 109.127 169.561 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.96 -46.57 87.74 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 123.59 0.756 . . . . 0.0 110.629 179.368 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -57.08 -44.2 82.89 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.878 0.871 . . . . 0.0 111.293 173.546 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.91 -11.81 57.41 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.039 0.935 . . . . 0.0 113.434 174.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 50.2 m-80 -126.42 9.47 7.21 Favored 'General case' 0 C--N 1.343 0.31 0 C-N-CA 124.507 1.123 . . . . 0.0 112.656 -172.543 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 14.8 m 58.12 40.51 25.06 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 122.445 1.117 . . . . 0.0 111.05 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.255 6.7 m-85 71.99 13.02 6.0 Favored 'General case' 0 N--CA 1.444 -0.736 0 C-N-CA 127.888 2.475 . . . . 0.0 114.791 168.448 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 63.4 mtm -69.61 86.92 0.47 Allowed 'General case' 0 N--CA 1.441 -0.91 0 C-N-CA 125.116 1.367 . . . . 0.0 109.917 170.678 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -56.05 -20.94 19.01 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.089 0.556 . . . . 0.0 111.7 170.05 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 6.4 m -58.25 -37.39 74.84 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 127.56 2.344 . . . . 0.0 113.014 169.333 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 56.9 mmtt -75.75 -48.68 20.8 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 124.252 1.021 . . . . 0.0 108.736 173.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 83.9 m -71.33 6.57 1.68 Allowed 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 125.338 1.455 . . . . 0.0 112.95 -177.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -52.14 -32.34 35.24 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 120.129 1.332 . . . . 0.0 111.914 169.416 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.56 -56.23 24.54 Favored 'General case' 0 C--N 1.342 0.282 0 C-N-CA 125.117 1.367 . . . . 0.0 111.649 173.035 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.8 p -75.49 -29.51 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.872 0 C-N-CA 124.004 0.922 . . . . 0.0 109.934 -174.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.431 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 1.5 mp -58.38 -49.35 82.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 N-CA-C 105.648 -1.982 . . . . 0.0 105.648 167.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.75 -22.77 62.55 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 118.896 0.771 . . . . 0.0 112.778 177.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -76.82 -41.44 44.33 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 119.39 -0.924 . . . . 0.0 110.406 173.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.455 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 2.7 mt -62.8 -30.85 71.78 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 119.364 0.984 . . . . 0.0 110.667 170.354 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.2 mmt85 -62.4 -57.68 10.4 Favored 'General case' 0 C--N 1.339 0.135 0 CA-C-N 119.73 1.15 . . . . 0.0 108.307 176.266 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 20.4 pttm -69.62 -23.09 63.45 Favored 'General case' 0 C--O 1.234 0.241 0 O-C-N 123.484 0.49 . . . . 0.0 111.46 -175.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 46.7 t -68.21 -54.15 19.83 Favored 'General case' 0 N--CA 1.439 -1.0 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 166.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.0 t -61.55 -50.59 72.04 Favored 'General case' 0 CA--C 1.516 -0.362 0 C-N-CA 124.691 1.196 . . . . 0.0 112.912 -169.33 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.76 0.06 3.65 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.988 0.915 . . . . 0.0 112.82 -173.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.556 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 10.6 tt0 -84.58 -8.87 58.75 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 127.041 2.136 . . . . 0.0 111.378 179.075 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.556 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 81.5 m-85 -137.46 155.76 75.31 Favored Pre-proline 0 N--CA 1.439 -1.011 0 C-N-CA 126.813 2.045 . . . . 0.0 110.87 -166.635 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -69.51 105.99 1.54 Allowed 'Trans proline' 0 N--CA 1.457 -0.653 0 N-CA-C 104.233 -3.026 . . . . 0.0 104.233 165.754 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 63.0 pttt -39.27 -34.25 0.18 Allowed 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 118.772 2.878 . . . . 0.0 118.772 -163.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -55.3 -18.75 14.78 Favored Glycine 0 CA--C 1.541 1.684 0 CA-C-N 120.346 1.43 . . . . 0.0 114.202 172.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 4.2 tpm_? -57.82 -15.73 9.26 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 128.069 2.547 . . . . 0.0 112.598 169.056 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.1 t -148.49 137.52 21.72 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-O 122.816 1.293 . . . . 0.0 111.587 177.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 15.9 t -68.08 -53.25 31.0 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 CA-C-N 113.867 -1.515 . . . . 0.0 108.664 177.369 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.6 m -60.57 -42.29 91.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 CA-C-O 118.768 -0.634 . . . . 0.0 110.217 -177.501 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . 0.424 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 13.0 t -64.61 -36.36 83.99 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.953 1.701 . . . . 0.0 110.274 177.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.9 m -66.04 -27.18 67.91 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 119.081 -0.485 . . . . 0.0 110.686 172.226 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.69 -36.18 67.04 Favored Glycine 0 C--N 1.343 0.968 0 CA-C-O 123.072 1.373 . . . . 0.0 111.457 168.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.455 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.8 OUTLIER -73.51 -42.5 61.72 Favored 'General case' 0 N--CA 1.422 -1.869 0 N-CA-C 116.438 2.014 . . . . 0.0 116.438 -164.783 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 . . . . . 0 N--CA 1.446 -0.635 0 CA-C-O 118.472 -0.775 . . . . 0.0 110.359 174.82 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 37.1 t0 . . . . . 0 N--CA 1.449 -0.493 0 N-CA-C 108.65 -0.871 . . . . 0.0 108.65 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -58.51 -31.03 93.47 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 123.988 3.125 . . . . 0.0 112.865 -174.465 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 56.2 m -93.75 -10.27 34.81 Favored 'General case' 0 N--CA 1.438 -1.041 0 C-N-CA 125.06 1.344 . . . . 0.0 112.523 -171.91 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.6 tp60 -62.74 -26.58 68.77 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 118.821 0.737 . . . . 0.0 110.623 178.344 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -56.48 -54.09 49.84 Favored 'General case' 0 C--O 1.226 -0.168 0 C-N-CA 123.745 0.818 . . . . 0.0 109.942 169.364 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -63.94 -46.79 83.15 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 118.47 -0.776 . . . . 0.0 109.604 -178.202 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -51.06 -40.05 57.42 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.772 1.229 . . . . 0.0 112.969 171.3 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 61.2 m -62.2 -43.0 99.81 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 119.407 -0.33 . . . . 0.0 110.642 172.2 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -64.73 -29.97 70.96 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 117.346 -1.311 . . . . 0.0 112.981 177.339 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.9 mp -57.39 -50.58 76.49 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 CA-C-N 121.021 1.737 . . . . 0.0 109.166 169.26 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 34.2 mm-40 -59.53 -54.59 44.79 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 178.584 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 53.6 mmtt -68.42 -30.8 69.78 Favored 'General case' 0 C--O 1.227 -0.116 0 C-N-CA 118.697 -1.201 . . . . 0.0 111.418 -172.807 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 19.9 t -56.21 -48.94 75.44 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 168.488 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.68 -47.35 82.58 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 118.866 -0.588 . . . . 0.0 110.523 178.808 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -56.74 -46.49 81.33 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.528 0.731 . . . . 0.0 111.199 174.618 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.71 -13.71 59.82 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.113 0.965 . . . . 0.0 113.518 175.759 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.6 m-80 -122.05 8.18 9.82 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 124.772 1.229 . . . . 0.0 111.946 -173.385 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 58.08 40.42 25.25 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 119.566 1.076 . . . . 0.0 110.853 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.261 7.0 m-85 72.29 14.27 5.51 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 127.816 2.447 . . . . 0.0 114.457 168.876 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 68.4 mtm -70.4 82.42 0.56 Allowed 'General case' 0 N--CA 1.441 -0.882 0 C-N-CA 125.212 1.405 . . . . 0.0 109.793 169.836 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -53.19 -24.14 10.17 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.366 1.066 . . . . 0.0 111.668 171.684 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.6 m -52.11 -40.08 60.76 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 126.517 1.927 . . . . 0.0 112.409 170.113 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 45.7 mmtt -72.16 -48.62 42.07 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 124.481 1.113 . . . . 0.0 108.706 174.813 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 78.9 m -73.59 1.38 10.21 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.299 1.44 . . . . 0.0 113.614 -173.763 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 53.4 mm-40 -52.65 -34.13 50.1 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 119.681 1.128 . . . . 0.0 111.222 169.123 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.23 -54.86 42.02 Favored 'General case' 0 C--N 1.343 0.291 0 C-N-CA 125.02 1.328 . . . . 0.0 111.387 175.011 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.0 p -75.59 -31.19 22.81 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.831 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.236 -173.034 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 75.2 mt -58.98 -45.9 91.87 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 N-CA-C 106.656 -1.609 . . . . 0.0 106.656 168.489 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.37 -27.57 62.42 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 120.969 -1.082 . . . . 0.0 113.052 173.662 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -76.47 -29.78 57.03 Favored 'General case' 0 N--CA 1.437 -1.097 0 C-N-CA 119.571 -0.851 . . . . 0.0 110.86 175.656 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.434 ' HB3' ' CE2' ' A' ' 53' ' ' PHE . 3.6 mt -64.45 -29.71 70.76 Favored 'General case' 0 C--N 1.343 0.311 0 CA-C-N 119.688 1.131 . . . . 0.0 109.213 168.648 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 16.7 mmt85 -66.03 -55.81 14.77 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 119.805 1.184 . . . . 0.0 108.719 -178.808 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.9 pttp -66.25 -27.11 67.71 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.157 -178.83 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 42.7 t -65.43 -54.83 22.93 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 168.397 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.1 t -62.55 -46.38 88.63 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 124.127 0.971 . . . . 0.0 112.137 -169.191 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.55 -4.02 10.44 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.003 -0.999 . . . . 0.0 112.879 -178.241 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.421 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 2.8 tp-100 -86.2 -6.2 59.04 Favored 'General case' 0 N--CA 1.439 -1.014 0 C-N-CA 124.851 1.26 . . . . 0.0 111.697 -178.753 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.421 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 72.3 m-85 -136.0 159.76 69.87 Favored Pre-proline 0 N--CA 1.446 -0.642 0 C-N-CA 124.434 1.094 . . . . 0.0 111.387 -168.949 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -67.76 109.24 1.84 Allowed 'Trans proline' 0 N--CA 1.455 -0.764 0 N-CA-C 104.778 -2.816 . . . . 0.0 104.778 165.389 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 38.5 mmtm -39.78 -38.43 0.65 Allowed 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 117.164 2.283 . . . . 0.0 117.164 -165.372 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.58 -17.23 25.86 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 123.854 0.74 . . . . 0.0 113.936 175.718 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 2.0 ttm180 -66.77 -8.08 25.83 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 126.946 2.098 . . . . 0.0 112.653 172.266 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 5.8 t -147.34 136.21 22.14 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 122.912 1.339 . . . . 0.0 112.076 174.415 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 19.9 t -71.73 -50.78 36.54 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.74 0 CA-C-N 113.615 -1.63 . . . . 0.0 108.762 176.717 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.4 m -60.34 -43.68 94.25 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.335 0 CA-C-O 118.402 -0.809 . . . . 0.0 109.835 179.722 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 25.5 t -63.22 -34.57 77.94 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.011 1.724 . . . . 0.0 110.451 178.131 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 48.7 m -65.73 -28.93 69.41 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 122.998 0.519 . . . . 0.0 110.875 171.588 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -67.68 -40.71 90.19 Favored Glycine 0 C--N 1.344 0.995 0 CA-C-O 124.167 1.982 . . . . 0.0 110.952 167.432 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.434 ' CE2' ' HB3' ' A' ' 35' ' ' LEU . 1.2 t80 -73.94 -40.29 63.18 Favored 'General case' 0 N--CA 1.417 -2.122 0 CA-C-N 111.786 -2.207 . . . . 0.0 116.128 -164.581 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 . . . . . 0 C--N 1.322 -0.614 0 CA-C-O 118.324 -0.846 . . . . 0.0 110.638 170.929 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.8 t0 . . . . . 0 CA--C 1.539 0.553 0 N-CA-C 106.245 -1.761 . . . . 0.0 106.245 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -68.67 -17.79 42.63 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 125.097 3.865 . . . . 0.0 113.672 -169.532 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.417 ' HB3' ' CD2' ' A' ' 35' ' ' LEU . 98.6 m -105.32 -9.3 17.7 Favored 'General case' 0 N--CA 1.435 -1.224 0 C-N-CA 127.056 2.143 . . . . 0.0 111.835 -170.451 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 16.9 tp60 -67.41 -22.48 65.53 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.704 -171.467 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -70.36 -46.79 63.41 Favored 'General case' 0 C--O 1.225 -0.232 0 O-C-N 121.449 -0.782 . . . . 0.0 110.057 173.687 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 19.0 mp0 -65.27 -40.57 94.1 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 127.255 2.222 . . . . 0.0 108.237 -172.583 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -52.16 -43.26 63.99 Favored 'General case' 0 C--N 1.34 0.166 0 C-N-CA 126.166 1.787 . . . . 0.0 112.707 169.232 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 84.0 m -60.99 -45.13 96.06 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.925 0.393 . . . . 0.0 110.299 175.709 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -63.83 -22.54 66.96 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 117.711 -1.137 . . . . 0.0 112.541 179.278 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 31.6 mm -59.17 -54.72 30.36 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.216 0 CA-C-N 120.408 1.458 . . . . 0.0 109.17 171.271 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -61.52 -51.79 67.15 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 -177.739 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 16.6 mtpp -67.9 -30.72 70.14 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 118.245 -0.884 . . . . 0.0 111.568 -174.725 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 15.6 t -58.51 -47.87 82.71 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-N 119.41 1.004 . . . . 0.0 108.512 168.787 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.72 -47.15 83.24 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 123.339 0.655 . . . . 0.0 110.392 178.997 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -58.45 -42.23 86.9 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.983 0.913 . . . . 0.0 111.681 174.195 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.63 -10.68 57.58 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 174.374 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -128.33 9.02 6.07 Favored 'General case' 0 C--N 1.344 0.362 0 CA-C-N 119.421 1.009 . . . . 0.0 112.59 -171.852 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 16.2 m 61.03 38.87 16.96 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 119.496 1.044 . . . . 0.0 110.39 177.777 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.265 7.1 m-85 72.2 14.81 5.52 Favored 'General case' 0 N--CA 1.444 -0.735 0 C-N-CA 127.656 2.382 . . . . 0.0 114.431 168.788 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 58.7 mtm -70.9 85.94 0.69 Allowed 'General case' 0 N--CA 1.441 -0.9 0 C-N-CA 124.84 1.256 . . . . 0.0 109.881 170.616 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -52.56 -24.85 9.0 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.265 1.026 . . . . 0.0 111.149 169.556 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.4 m -53.77 -38.83 64.86 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 127.511 2.324 . . . . 0.0 113.013 170.409 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.411 ' HA ' ' HE2' ' A' ' 27' ' ' LYS . 9.9 mmpt? -75.74 -47.6 25.33 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 173.45 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.6 m -71.89 2.64 5.22 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.626 1.17 . . . . 0.0 113.401 -174.568 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -52.98 -30.96 38.16 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 119.439 1.018 . . . . 0.0 110.695 167.763 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.65 -59.58 5.21 Favored 'General case' 0 C--N 1.346 0.444 0 C-N-CA 125.616 1.566 . . . . 0.0 111.68 173.7 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.5 p -71.29 -29.5 36.14 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.716 0 C-N-CA 123.761 0.825 . . . . 0.0 110.08 -174.27 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.573 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 71.7 mt -59.91 -49.85 82.34 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 N-CA-C 106.543 -1.651 . . . . 0.0 106.543 169.239 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -56.86 -25.3 56.19 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 119.451 1.023 . . . . 0.0 112.909 175.482 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -74.84 -41.55 59.66 Favored 'General case' 0 N--CA 1.44 -0.953 0 CA-C-N 118.925 0.784 . . . . 0.0 110.819 173.802 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.47 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 2.4 mt -62.92 -31.31 72.35 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-O 117.797 -1.097 . . . . 0.0 110.208 170.447 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.9 mmt85 -63.37 -56.4 16.64 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 120.067 1.303 . . . . 0.0 108.443 179.076 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.8 pttt -67.65 -28.4 67.68 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.951 -174.517 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 47.8 t -66.55 -54.51 22.86 Favored 'General case' 0 N--CA 1.44 -0.925 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 168.246 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.8 t -59.48 -50.06 75.4 Favored 'General case' 0 CA--C 1.512 -0.512 0 C-N-CA 124.332 1.053 . . . . 0.0 111.842 -169.573 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.11 -1.53 6.15 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.025 -0.989 . . . . 0.0 112.414 -174.608 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.511 ' HB3' ' CE2' ' A' ' 42' ' ' TYR . 2.0 tp-100 -81.9 -10.28 59.34 Favored 'General case' 0 N--CA 1.436 -1.158 0 C-N-CA 124.344 1.058 . . . . 0.0 111.578 174.76 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.511 ' CE2' ' HB3' ' A' ' 41' ' ' GLN . 68.7 m-85 -138.71 158.91 69.32 Favored Pre-proline 0 N--CA 1.445 -0.712 0 C-N-CA 124.187 0.995 . . . . 0.0 112.014 -167.666 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -72.1 147.62 48.92 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 121.735 1.623 . . . . 0.0 108.373 167.622 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -51.94 -42.93 63.23 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 -173.669 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.96 -14.24 23.11 Favored Glycine 0 CA--C 1.53 0.974 0 CA-C-O 119.032 -0.871 . . . . 0.0 113.257 -178.858 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.54 -17.08 56.71 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 118.894 1.347 . . . . 0.0 113.095 176.052 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 9.6 t -151.95 128.51 10.74 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-O 123.537 1.636 . . . . 0.0 112.901 -175.234 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 12.0 t -68.5 -50.85 52.56 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 CA-C-N 112.679 -2.055 . . . . 0.0 108.698 178.942 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 16.0 m -61.84 -43.53 97.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 CA-C-O 118.46 -0.781 . . . . 0.0 110.083 -178.578 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 18.5 t -63.86 -34.58 78.26 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.582 1.553 . . . . 0.0 110.227 177.886 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.0 m -65.07 -29.64 70.54 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 122.788 0.435 . . . . 0.0 110.675 171.99 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.1 -37.54 82.44 Favored Glycine 0 C--N 1.344 1.002 0 CA-C-O 123.089 1.383 . . . . 0.0 111.104 167.987 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.573 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 1.3 t80 -75.08 -40.25 60.25 Favored 'General case' 0 N--CA 1.417 -2.075 0 N-CA-C 117.097 2.258 . . . . 0.0 117.097 -163.74 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 . . . . . 0 CA--C 1.542 0.651 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.674 171.853 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.0 t0 . . . . . 0 N--CA 1.446 -0.669 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -55.25 -34.58 88.75 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 124.091 3.194 . . . . 0.0 112.77 -173.695 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 85.7 m -94.9 -13.09 25.76 Favored 'General case' 0 N--CA 1.436 -1.168 0 C-N-CA 125.403 1.481 . . . . 0.0 113.581 -168.305 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.1 tp60 -61.29 -26.57 67.87 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 122.99 0.516 . . . . 0.0 110.803 -179.968 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.2 ttpp -62.29 -54.31 42.57 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.521 0.728 . . . . 0.0 110.377 169.971 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 27.1 mm-40 -59.12 -44.83 92.04 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.405 0.682 . . . . 0.0 110.107 -177.293 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -51.26 -42.58 61.17 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 125.728 1.611 . . . . 0.0 112.626 170.846 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.425 ' HB3' ' HE2' ' A' ' 16' ' ' LYS . 93.8 m -61.66 -46.27 90.45 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 117.854 0.297 . . . . 0.0 110.931 173.004 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -62.59 -22.22 66.21 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 117.662 -1.161 . . . . 0.0 112.633 179.091 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 27.3 mm -57.78 -53.61 42.67 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.218 0 CA-C-N 120.397 1.453 . . . . 0.0 109.614 171.796 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 -58.64 -55.85 29.75 Favored 'General case' 0 N--CA 1.445 -0.678 0 O-C-N 124.19 0.932 . . . . 0.0 109.002 -179.316 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.425 ' HE2' ' HB3' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -66.65 -31.54 72.28 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 118.807 -1.157 . . . . 0.0 112.138 -175.004 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 24.1 t -55.67 -48.72 74.58 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 119.491 1.041 . . . . 0.0 108.758 169.18 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.44 -46.7 86.02 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-O 118.863 -0.589 . . . . 0.0 110.48 179.533 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -57.03 -46.33 82.47 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.419 0.688 . . . . 0.0 111.34 174.402 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.49 -13.03 57.95 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.262 1.025 . . . . 0.0 113.4 175.66 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -123.21 8.54 9.16 Favored 'General case' 0 C--N 1.342 0.26 0 C-N-CA 124.66 1.184 . . . . 0.0 111.959 -173.333 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.3 m 58.23 40.13 25.08 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 119.636 1.107 . . . . 0.0 110.863 179.415 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.26 7.0 m-85 72.19 13.98 5.65 Favored 'General case' 0 N--CA 1.443 -0.796 0 C-N-CA 127.957 2.503 . . . . 0.0 114.499 168.902 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 67.0 mtm -69.93 84.72 0.5 Allowed 'General case' 0 N--CA 1.44 -0.955 0 C-N-CA 125.204 1.402 . . . . 0.0 109.837 170.002 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -53.79 -25.07 17.48 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.502 0.721 . . . . 0.0 111.524 171.105 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.2 m -53.1 -38.64 62.77 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 126.413 1.885 . . . . 0.0 112.631 170.691 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.8 mmtm -72.95 -47.73 42.95 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.267 1.027 . . . . 0.0 108.671 173.454 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.3 m -73.74 3.24 6.76 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 124.797 1.239 . . . . 0.0 113.637 -173.074 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 64.2 mm-40 -54.82 -29.72 55.46 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.2 -0.937 . . . . 0.0 110.542 167.067 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.71 -55.39 35.75 Favored 'General case' 0 C--N 1.345 0.4 0 C-N-CA 125.567 1.547 . . . . 0.0 111.708 172.606 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.5 p -75.81 -29.37 20.14 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 C-N-CA 123.605 0.762 . . . . 0.0 110.16 -173.467 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 59.2 mt -61.04 -46.78 96.0 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 N-CA-C 106.058 -1.83 . . . . 0.0 106.058 168.213 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.81 -26.58 62.18 Favored 'General case' 0 N--CA 1.453 -0.304 0 O-C-N 120.853 -1.155 . . . . 0.0 113.436 172.884 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -76.39 -32.32 58.49 Favored 'General case' 0 N--CA 1.432 -1.33 0 C-N-CA 119.492 -0.883 . . . . 0.0 110.743 175.705 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.8 mt -64.02 -32.83 74.51 Favored 'General case' 0 C--O 1.22 -0.455 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 168.46 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.4 mmt85 -64.71 -57.23 9.55 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 119.913 1.233 . . . . 0.0 109.24 -179.119 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.9 pttp -64.95 -29.64 70.58 Favored 'General case' 0 C--O 1.233 0.186 0 O-C-N 123.543 0.527 . . . . 0.0 111.087 -176.082 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 51.1 t -65.27 -54.19 32.95 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 168.729 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 48.7 t -62.6 -47.07 85.39 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 121.514 -0.741 . . . . 0.0 111.838 -169.921 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.53 -0.89 7.34 Favored 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 124.484 1.114 . . . . 0.0 112.429 -176.728 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.465 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 1.8 tp-100 -77.28 -11.52 59.84 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-N 119.1 0.864 . . . . 0.0 111.572 171.667 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.465 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 54.1 m-85 -141.44 160.64 56.25 Favored Pre-proline 0 N--CA 1.438 -1.053 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -164.23 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -69.82 114.85 3.85 Favored 'Trans proline' 0 N--CA 1.455 -0.758 0 N-CA-C 105.283 -2.622 . . . . 0.0 105.283 165.069 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.43 -29.57 1.14 Allowed 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 117.586 2.439 . . . . 0.0 117.586 -166.577 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -54.1 -17.16 7.16 Favored Glycine 0 CA--C 1.538 1.509 0 CA-C-N 119.601 1.091 . . . . 0.0 114.075 171.852 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.4 ' HG2' ' CG ' ' A' ' 42' ' ' TYR . 8.3 tpm_? -52.16 -29.15 20.81 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 127.589 2.356 . . . . 0.0 112.386 168.017 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.4 t -149.25 139.82 22.55 Favored 'General case' 0 N--CA 1.439 -1.012 0 CA-C-O 122.804 1.288 . . . . 0.0 112.048 -168.277 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.1 t -67.79 -55.03 18.4 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.658 0 CA-C-N 113.747 -1.569 . . . . 0.0 108.704 176.655 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.3 m -61.19 -43.2 95.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 CA-C-O 118.382 -0.818 . . . . 0.0 109.954 -177.106 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 29.5 t -64.57 -32.07 73.56 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.4 1.48 . . . . 0.0 110.18 178.934 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 52.3 m -67.25 -26.93 66.82 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 119.075 -0.488 . . . . 0.0 110.893 171.742 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -71.0 -36.15 64.58 Favored Glycine 0 C--N 1.345 1.05 0 CA-C-O 123.798 1.776 . . . . 0.0 111.092 167.288 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -78.47 -40.3 35.91 Favored 'General case' 0 N--CA 1.412 -2.339 0 N-CA-C 116.293 1.96 . . . . 0.0 116.293 -163.846 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 . . . . . 0 N--CA 1.449 -0.5 0 C-N-CA 119.483 -0.887 . . . . 0.0 110.342 170.858 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 47.3 t0 . . . . . 0 CA--C 1.54 0.584 0 N-CA-C 109.589 -0.522 . . . . 0.0 109.589 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.54 -25.55 29.5 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 123.629 2.886 . . . . 0.0 112.4 -176.14 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 66.0 m -92.66 -11.51 33.93 Favored 'General case' 0 N--CA 1.435 -1.192 0 C-N-CA 124.518 1.127 . . . . 0.0 110.89 -170.699 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 21.4 tp60 -64.34 -25.0 67.84 Favored 'General case' 0 N--CA 1.442 -0.83 0 C-N-CA 123.36 0.664 . . . . 0.0 110.686 179.599 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -62.14 -53.83 49.79 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 123.477 0.711 . . . . 0.0 110.02 169.115 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -62.97 -38.89 92.9 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.043 0.537 . . . . 0.0 109.675 -176.662 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.32 -44.38 72.0 Favored 'General case' 0 C--N 1.342 0.272 0 C-N-CA 125.327 1.451 . . . . 0.0 112.222 169.784 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 85.3 m -58.54 -45.82 88.12 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 117.734 0.243 . . . . 0.0 110.531 173.573 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.0 mm-40 -67.3 -16.63 64.38 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 117.495 -1.24 . . . . 0.0 112.681 -179.864 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 42.2 mm -59.85 -54.3 36.59 Favored 'Isoleucine or valine' 0 C--N 1.34 0.17 0 CA-C-N 121.09 1.768 . . . . 0.0 107.847 169.118 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 50.9 mm-40 -57.27 -52.77 63.98 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.249 -0.887 . . . . 0.0 109.202 174.291 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 18.5 mmmt -65.34 -32.32 73.9 Favored 'General case' 0 C--N 1.334 -0.073 0 C-N-CA 118.741 -1.184 . . . . 0.0 111.757 -172.913 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 17.5 t -57.69 -51.45 69.47 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 169.72 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.65 -47.77 73.13 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.968 0.907 . . . . 0.0 110.876 178.229 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.461 ' HA ' ' CE1' ' A' ' 23' ' ' TYR . 0.6 OUTLIER -55.9 -45.36 78.68 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.024 0.93 . . . . 0.0 111.473 174.07 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.88 -10.99 60.57 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 114.381 1.252 . . . . 0.0 114.381 176.577 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -126.37 16.51 7.7 Favored 'General case' 0 C--N 1.343 0.321 0 CA-C-N 119.806 1.185 . . . . 0.0 113.749 -168.401 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 17.6 m 60.17 34.68 21.1 Favored 'General case' 0 C--N 1.345 0.401 0 CA-C-N 120.523 1.511 . . . . 0.0 110.285 -179.192 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.461 ' CE1' ' HA ' ' A' ' 19' ' ' GLN . 46.4 m-85 67.33 16.43 10.09 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 126.832 2.053 . . . . 0.0 113.719 168.406 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 65.2 mtm -73.7 90.98 1.86 Allowed 'General case' 0 N--CA 1.439 -0.987 0 C-N-CA 126.168 1.787 . . . . 0.0 109.114 175.368 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -54.68 -23.56 17.97 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.982 -0.449 . . . . 0.0 111.469 170.862 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.2 m -53.73 -41.32 66.94 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 126.588 1.955 . . . . 0.0 112.412 170.299 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 61.2 mmtt -71.29 -45.99 61.83 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 124.103 0.961 . . . . 0.0 108.891 173.581 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 86.3 m -73.97 3.47 6.79 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 124.336 1.054 . . . . 0.0 113.012 -172.88 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 79.8 mm-40 -56.45 -27.74 57.66 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.467 -0.771 . . . . 0.0 110.541 166.234 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.31 -60.46 3.78 Favored 'General case' 0 C--N 1.345 0.39 0 C-N-CA 125.403 1.481 . . . . 0.0 111.423 172.003 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.1 p -71.62 -25.92 25.35 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 C-N-CA 123.835 0.854 . . . . 0.0 110.004 -175.093 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 17.0 mt -60.02 -52.46 60.9 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 N-CA-C 106.684 -1.599 . . . . 0.0 106.684 168.101 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.452 ' HA ' ' CG ' ' A' ' 36' ' ' ARG . 8.6 tt0 -55.25 -36.65 66.29 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-O 118.792 -0.623 . . . . 0.0 110.305 178.588 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -65.25 -41.99 93.74 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 118.685 0.675 . . . . 0.0 111.703 176.065 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.538 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 0.7 OUTLIER -61.44 -38.59 87.72 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-O 117.005 -1.474 . . . . 0.0 110.418 173.236 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.452 ' CG ' ' HA ' ' A' ' 33' ' ' GLN 0.275 9.3 ptt85 -70.08 -39.76 75.4 Favored 'General case' 0 C--N 1.341 0.226 0 CA-C-N 120.66 1.573 . . . . 0.0 110.605 -179.865 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.8 mmtp -64.14 -37.1 86.22 Favored 'General case' 0 C--N 1.344 0.34 0 CA-C-N 118.716 0.689 . . . . 0.0 111.188 175.859 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 49.3 t -60.66 -53.18 60.5 Favored 'General case' 0 C--O 1.22 -0.448 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 170.528 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . 0.466 ' HA ' HH12 ' A' ' 46' ' ' ARG . 42.3 t -57.56 -44.97 85.64 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 125.306 1.443 . . . . 0.0 113.142 -169.646 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.33 -1.11 25.15 Favored 'General case' 0 N--CA 1.441 -0.902 0 O-C-N 124.67 1.231 . . . . 0.0 112.631 -176.268 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.457 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 3.5 tp-100 -91.86 -1.85 57.13 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 124.23 1.012 . . . . 0.0 112.754 -168.827 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.555 ' HB2' ' CZ ' ' A' ' 46' ' ' ARG . 84.7 m-85 -142.56 165.97 23.66 Favored Pre-proline 0 N--CA 1.443 -0.781 0 C-N-CA 125.985 1.714 . . . . 0.0 110.641 -167.474 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -61.93 139.93 82.21 Favored 'Trans proline' 0 CA--C 1.538 0.68 0 C-N-CA 121.798 1.665 . . . . 0.0 109.433 169.164 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm -71.44 -5.51 33.43 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 114.699 1.37 . . . . 0.0 114.699 -169.186 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -86.86 -12.79 68.01 Favored Glycine 0 CA--C 1.533 1.179 0 CA-C-O 118.636 -1.091 . . . . 0.0 113.669 169.933 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.555 ' CZ ' ' HB2' ' A' ' 42' ' ' TYR . 0.0 OUTLIER -74.39 -9.85 59.0 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.768 1.784 . . . . 0.0 112.757 -173.596 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.407 ' HB2' ' HD2' ' A' ' 46' ' ' ARG . 16.0 t -145.4 146.26 31.48 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 120.909 -1.119 . . . . 0.0 112.053 -174.656 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 23.6 t -84.26 -55.11 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 C-N-CA 126.177 1.791 . . . . 0.0 108.826 173.103 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.8 m -58.22 -41.35 80.75 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 118.212 0.46 . . . . 0.0 110.745 -173.724 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . 0.412 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 9.2 t -64.22 -34.48 78.19 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.281 1.433 . . . . 0.0 109.871 -179.928 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.1 p -64.94 -27.16 68.65 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 121.995 -0.44 . . . . 0.0 111.016 174.065 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.09 -45.12 58.01 Favored Glycine 0 C--N 1.348 1.196 0 CA-C-O 123.902 1.834 . . . . 0.0 110.172 168.391 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.538 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.6 OUTLIER -63.73 -39.74 95.04 Favored 'General case' 0 N--CA 1.415 -2.19 0 CA-C-N 111.937 -2.131 . . . . 0.0 115.354 -167.276 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 . . . . . 0 C--N 1.321 -0.667 0 CA-C-O 118.649 -0.691 . . . . 0.0 111.079 178.747 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.9 t0 . . . . . 0 N--CA 1.441 -0.883 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -60.47 -16.63 43.21 Favored 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 124.31 3.34 . . . . 0.0 114.948 -173.65 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 64.2 m -108.57 -6.97 15.82 Favored 'General case' 0 N--CA 1.441 -0.92 0 C-N-CA 127.027 2.131 . . . . 0.0 112.272 -170.465 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 8.0 tp60 -67.89 -22.79 65.07 Favored 'General case' 0 N--CA 1.447 -0.597 0 O-C-N 121.615 -0.678 . . . . 0.0 112.278 -173.018 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 47.5 tptt -67.26 -49.56 63.93 Favored 'General case' 0 C--O 1.226 -0.143 0 CA-C-O 122.028 0.918 . . . . 0.0 109.446 173.456 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 20.4 mp0 -61.64 -43.13 99.44 Favored 'General case' 0 N--CA 1.442 -0.86 0 C-N-CA 127.641 2.377 . . . . 0.0 107.995 -173.962 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -53.78 -41.32 67.1 Favored 'General case' 0 C--N 1.341 0.213 0 C-N-CA 126.562 1.945 . . . . 0.0 114.016 169.797 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.0 m -63.27 -44.84 93.98 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 122.408 0.283 . . . . 0.0 110.263 173.716 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -64.83 -24.88 67.68 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 117.688 -1.148 . . . . 0.0 112.243 179.739 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 37.5 mm -56.54 -50.87 71.36 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.221 0 CA-C-N 120.273 1.397 . . . . 0.0 109.4 169.453 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 45.8 mm-40 -59.97 -56.28 23.68 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 106.971 -1.492 . . . . 0.0 106.971 -175.145 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 44.5 mttt -70.41 -30.19 67.0 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 118.182 -0.913 . . . . 0.0 111.233 -171.618 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 18.9 t -57.26 -47.06 82.37 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 169.185 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.26 -45.75 90.36 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 118.435 -0.793 . . . . 0.0 110.169 179.649 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -58.29 -45.68 87.5 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 119.328 0.967 . . . . 0.0 111.301 174.255 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.93 -13.94 58.53 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 175.862 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -123.86 9.25 8.8 Favored 'General case' 0 C--N 1.343 0.322 0 C-N-CA 124.302 1.041 . . . . 0.0 112.24 -172.928 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.4 m 58.03 40.45 25.39 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 122.404 1.097 . . . . 0.0 110.842 179.369 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.265 6.8 m-85 72.25 14.36 5.53 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 127.801 2.44 . . . . 0.0 114.428 168.79 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 63.0 mtm -69.45 86.27 0.44 Allowed 'General case' 0 N--CA 1.442 -0.843 0 C-N-CA 125.175 1.39 . . . . 0.0 110.329 170.122 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -54.36 -22.97 13.68 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.457 1.103 . . . . 0.0 111.323 169.486 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.6 m -58.02 -40.64 81.35 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 127.027 2.131 . . . . 0.0 112.631 170.085 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.7 mmtm -72.91 -47.73 43.2 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 124.138 0.975 . . . . 0.0 108.561 174.375 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.0 m -70.14 3.33 2.87 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.034 1.334 . . . . 0.0 113.424 -176.791 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 85.1 mm-40 -53.37 -31.7 45.86 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 119.304 0.956 . . . . 0.0 111.122 167.204 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.64 -50.16 74.93 Favored 'General case' 0 C--N 1.344 0.362 0 C-N-CA 125.028 1.331 . . . . 0.0 112.116 174.851 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.7 p -80.91 -29.96 11.66 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.809 0 C-N-CA 123.391 0.677 . . . . 0.0 109.845 -174.256 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.569 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 68.8 mt -63.25 -40.66 89.9 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 169.366 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.67 -34.71 59.61 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 123.727 0.811 . . . . 0.0 112.001 170.232 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -74.85 -42.8 57.25 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 119.806 -0.758 . . . . 0.0 110.846 179.504 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.458 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 2.4 mt -64.23 -30.9 71.94 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 118.276 -0.869 . . . . 0.0 110.311 174.425 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.22 -61.88 2.27 Favored 'General case' 0 CA--C 1.518 -0.269 0 C-N-CA 124.437 1.095 . . . . 0.0 108.756 175.661 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -64.58 -28.12 69.41 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 114.372 -1.286 . . . . 0.0 110.66 -173.499 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 49.4 t -66.28 -55.37 16.41 Favored 'General case' 0 N--CA 1.442 -0.83 0 C-N-CA 123.511 0.724 . . . . 0.0 109.258 168.273 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 47.8 t -60.0 -43.81 94.95 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 123.94 0.896 . . . . 0.0 112.516 -170.859 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.85 -4.32 15.85 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.845 -1.07 . . . . 0.0 113.006 -176.313 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.458 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 3.1 tp-100 -91.7 -4.82 54.67 Favored 'General case' 0 N--CA 1.437 -1.084 0 C-N-CA 125.355 1.462 . . . . 0.0 112.122 -172.6 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.458 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 78.9 m-85 -139.15 161.32 58.3 Favored Pre-proline 0 N--CA 1.446 -0.628 0 C-N-CA 124.132 0.973 . . . . 0.0 112.244 -168.133 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -69.48 98.99 0.69 Allowed 'Trans proline' 0 N--CA 1.456 -0.709 0 N-CA-C 105.096 -2.694 . . . . 0.0 105.096 165.384 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.514 ' H ' ' HD2' ' A' ' 44' ' ' LYS . 2.8 mptp? -39.34 -30.69 0.07 Allowed 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 117.904 2.557 . . . . 0.0 117.904 -165.556 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -54.81 -18.44 11.28 Favored Glycine 0 CA--C 1.541 1.659 0 CA-C-N 120.219 1.372 . . . . 0.0 114.097 170.021 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.0 tpm_? -55.8 -24.04 33.63 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 127.95 2.5 . . . . 0.0 112.053 168.957 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.5 t -144.64 130.16 18.93 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-O 123.387 1.565 . . . . 0.0 112.497 -172.298 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.7 t -69.82 -49.8 54.35 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.758 0 CA-C-N 112.952 -1.931 . . . . 0.0 108.72 176.677 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.4 m -62.58 -42.04 94.38 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-O 118.512 -0.756 . . . . 0.0 110.352 -178.319 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . 0.427 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 7.7 t -64.82 -35.28 80.6 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.757 1.623 . . . . 0.0 110.191 176.235 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.3 m -65.44 -28.9 69.56 Favored 'General case' 0 CA--C 1.535 0.398 0 O-C-N 122.082 -0.386 . . . . 0.0 110.525 171.727 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.56 -32.99 71.42 Favored Glycine 0 C--N 1.345 1.052 0 CA-C-O 122.801 1.223 . . . . 0.0 111.366 167.939 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.569 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 0.9 OUTLIER -80.21 -42.08 23.98 Favored 'General case' 0 N--CA 1.422 -1.839 0 N-CA-C 116.103 1.89 . . . . 0.0 116.103 -165.211 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 . . . . . 0 C--N 1.321 -0.632 0 C-N-CA 119.841 -0.744 . . . . 0.0 110.404 171.014 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.2 t0 . . . . . 0 CA--C 1.546 0.815 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -61.52 -30.95 87.23 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 125.247 3.964 . . . . 0.0 113.056 -172.36 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.441 ' HB3' ' CD2' ' A' ' 35' ' ' LEU . 87.9 m -94.16 -15.55 24.53 Favored 'General case' 0 N--CA 1.436 -1.163 0 C-N-CA 125.134 1.374 . . . . 0.0 112.497 -168.552 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 21.7 tp60 -61.15 -24.62 66.42 Favored 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 123.6 0.76 . . . . 0.0 111.181 -179.958 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -63.42 -56.13 18.71 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.48 0.712 . . . . 0.0 110.215 169.018 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -60.6 -37.85 82.75 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.475 0.71 . . . . 0.0 110.389 -176.423 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.41 -39.84 67.7 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 125.48 1.512 . . . . 0.0 113.759 170.039 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.1 m -61.08 -45.18 95.78 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 123.052 0.22 . . . . 0.0 110.445 171.873 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 32.0 mm-40 -63.86 -27.82 69.43 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-O 117.801 -1.095 . . . . 0.0 112.186 179.417 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.414 HD13 HG13 ' A' ' 31' ' ' VAL . 43.1 mm -56.33 -50.62 70.88 Favored 'Isoleucine or valine' 0 C--N 1.341 0.227 0 CA-C-N 120.106 1.321 . . . . 0.0 109.516 170.541 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 47.4 mm-40 -59.13 -56.08 26.75 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 107.218 -1.401 . . . . 0.0 107.218 -175.099 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 24.7 mttm -70.79 -30.67 67.2 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 118.366 -0.826 . . . . 0.0 111.317 -172.15 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 26.0 t -56.86 -46.97 81.44 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 168.571 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.2 -43.99 92.24 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.471 179.877 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.402 HE21 ' HE1' ' A' ' 23' ' ' TYR . 3.1 mp0 -58.17 -46.95 84.84 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 119.434 1.015 . . . . 0.0 111.114 173.378 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.91 -14.8 56.45 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 176.152 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 56.8 m-80 -122.76 10.91 9.67 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.826 1.25 . . . . 0.0 111.439 -173.693 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.9 m 55.5 41.14 31.12 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 122.56 1.171 . . . . 0.0 110.817 177.758 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.402 ' HE1' HE21 ' A' ' 19' ' ' GLN 0.255 6.5 m-85 71.85 12.86 6.15 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 128.544 2.738 . . . . 0.0 114.095 169.816 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 61.3 mtm -72.9 85.71 1.26 Allowed 'General case' 0 N--CA 1.437 -1.121 0 C-N-CA 125.323 1.449 . . . . 0.0 109.166 171.938 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -52.3 -25.66 10.1 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.214 1.006 . . . . 0.0 111.25 169.826 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.2 m -52.65 -36.7 57.24 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 127.145 2.178 . . . . 0.0 113.003 170.501 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 63.1 mttt -83.72 -40.85 18.34 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.588 0.755 . . . . 0.0 109.827 175.064 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 82.9 m -72.04 6.22 2.26 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.475 1.11 . . . . 0.0 113.341 179.433 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 67.7 mm-40 -56.29 -29.18 60.85 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 121.141 -0.974 . . . . 0.0 110.878 167.264 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.97 -55.03 37.7 Favored 'General case' 0 C--N 1.345 0.372 0 C-N-CA 125.285 1.434 . . . . 0.0 111.636 173.799 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.414 HG13 HD13 ' A' ' 14' ' ' ILE . 7.2 p -74.99 -28.75 21.33 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.677 0 C-N-CA 123.549 0.74 . . . . 0.0 109.742 -175.229 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 35.6 mt -61.55 -47.9 91.24 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 168.853 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.452 ' HA ' ' HG2' ' A' ' 36' ' ' ARG . 0.3 OUTLIER -50.76 -40.74 55.61 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 123.597 0.56 . . . . 0.0 110.328 173.456 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -68.64 -39.98 80.49 Favored 'General case' 0 N--CA 1.434 -1.27 0 C-N-CA 119.996 -0.682 . . . . 0.0 111.065 -178.943 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.508 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.3 mt -66.06 -38.94 89.59 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 117.688 -1.149 . . . . 0.0 111.058 174.7 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.452 ' HG2' ' HA ' ' A' ' 33' ' ' GLN . 3.6 ptm180 -67.72 -40.11 84.24 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 120.019 1.281 . . . . 0.0 110.112 179.155 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt -63.22 -42.32 99.24 Favored 'General case' 0 C--N 1.342 0.282 0 C-N-CA 123.131 0.572 . . . . 0.0 110.377 176.191 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 51.8 t -58.04 -51.59 69.04 Favored 'General case' 0 C--O 1.218 -0.589 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 172.298 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.7 t -57.83 -46.09 85.22 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 123.765 0.826 . . . . 0.0 112.069 -173.167 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.67 -0.51 7.02 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.438 -0.801 . . . . 0.0 113.149 -177.782 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.557 ' HB3' ' CE2' ' A' ' 42' ' ' TYR . 17.9 tt0 -83.7 -9.7 58.67 Favored 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 123.722 0.809 . . . . 0.0 111.013 175.799 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.557 ' CE2' ' HB3' ' A' ' 41' ' ' GLN . 80.8 m-85 -139.08 160.4 62.74 Favored Pre-proline 0 N--CA 1.445 -0.724 0 C-N-CA 124.766 1.226 . . . . 0.0 111.725 -167.682 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -68.05 132.47 26.33 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 N-CA-C 105.956 -2.363 . . . . 0.0 105.956 165.758 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -50.27 -42.22 51.85 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.355 1.243 . . . . 0.0 114.355 -167.026 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.78 -11.63 31.03 Favored Glycine 0 CA--C 1.531 1.051 0 CA-C-O 119.081 -0.844 . . . . 0.0 113.555 -178.87 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.61 -19.43 65.77 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 118.916 1.358 . . . . 0.0 112.361 172.471 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.9 t -145.34 136.77 25.13 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-O 122.964 1.364 . . . . 0.0 111.912 -176.929 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.7 t -69.93 -54.24 19.99 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.635 0 CA-C-N 113.697 -1.592 . . . . 0.0 108.701 -179.701 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.6 m -61.34 -38.3 79.61 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 C-N-CA 122.668 0.387 . . . . 0.0 110.232 -179.2 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . 0.47 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 11.2 t -66.6 -37.72 85.48 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.726 0.81 . . . . 0.0 109.751 177.354 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.5 m -64.82 -20.96 66.68 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 119.036 -0.507 . . . . 0.0 111.367 173.02 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -80.76 -23.67 59.53 Favored Glycine 0 C--N 1.345 1.031 0 CA-C-N 118.918 0.781 . . . . 0.0 112.3 169.161 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.508 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -80.88 -49.58 10.85 Favored 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 125.052 1.341 . . . . 0.0 114.04 -166.876 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 . . . . . 0 C--N 1.32 -0.684 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.549 176.105 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.1 t0 . . . . . 0 CA--C 1.536 0.418 0 CA-C-O 118.699 -0.667 . . . . 0.0 109.349 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -57.5 -32.72 94.95 Favored 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 124.09 3.193 . . . . 0.0 112.639 -175.594 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 95.3 m -94.23 -11.94 29.22 Favored 'General case' 0 N--CA 1.436 -1.15 0 C-N-CA 125.085 1.354 . . . . 0.0 113.497 -168.899 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 24.6 tp60 -62.5 -27.49 69.18 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 122.767 0.427 . . . . 0.0 110.602 178.224 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.45 -56.99 14.95 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.666 0.786 . . . . 0.0 108.92 169.579 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -64.01 -36.34 83.65 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 121.868 -0.52 . . . . 0.0 110.556 -176.722 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -60.24 -36.75 78.44 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.261 1.025 . . . . 0.0 112.472 172.619 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.6 m -65.72 -41.78 91.85 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 118.062 0.392 . . . . 0.0 111.031 169.248 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -62.61 -27.49 69.24 Favored 'General case' 0 C--O 1.226 -0.159 0 CA-C-O 117.639 -1.172 . . . . 0.0 112.159 177.907 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.413 HD13 HG13 ' A' ' 31' ' ' VAL . 46.2 mm -55.24 -52.37 46.03 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-N 120.098 1.317 . . . . 0.0 109.372 169.895 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 46.9 mm-40 -61.07 -49.75 76.1 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 -173.023 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.4 mtpm? -70.41 -37.37 74.43 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.236 1.014 . . . . 0.0 111.825 -176.015 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 12.9 t -54.27 -43.52 71.06 Favored 'General case' 0 CA--C 1.513 -0.458 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 170.134 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.94 -45.95 89.2 Favored 'General case' 0 N--CA 1.441 -0.909 0 O-C-N 123.57 0.544 . . . . 0.0 109.644 -178.075 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.426 ' HA ' ' CE1' ' A' ' 23' ' ' TYR . 4.3 mm-40 -64.38 -41.75 96.51 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 119.138 0.881 . . . . 0.0 110.604 179.291 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.39 -11.24 14.51 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 171.833 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 55.2 m-80 -127.17 10.45 6.87 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.216 1.406 . . . . 0.0 112.105 -176.567 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 5.4 m 55.1 40.93 32.03 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 122.554 1.168 . . . . 0.0 111.859 -179.904 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.426 ' CE1' ' HA ' ' A' ' 19' ' ' GLN 0.257 7.1 m-85 74.03 13.46 4.08 Favored 'General case' 0 N--CA 1.443 -0.796 0 C-N-CA 128.827 2.851 . . . . 0.0 114.371 168.464 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 67.5 mtm -70.07 84.3 0.52 Allowed 'General case' 0 N--CA 1.441 -0.909 0 C-N-CA 125.063 1.345 . . . . 0.0 109.708 170.248 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -54.26 -24.88 20.52 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.301 0.64 . . . . 0.0 111.499 172.809 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 8.4 t -56.69 -34.93 67.9 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.304 1.042 . . . . 0.0 112.42 172.656 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.9 mmtm -72.99 -46.17 53.76 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.997 0.919 . . . . 0.0 108.527 173.176 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 84.0 m -72.05 1.65 7.02 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 124.363 1.065 . . . . 0.0 113.035 -174.853 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 77.3 mm-40 -57.94 -23.85 55.34 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 120.02 1.282 . . . . 0.0 110.364 166.047 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.58 -56.55 20.76 Favored 'General case' 0 C--N 1.347 0.477 0 C-N-CA 126.043 1.737 . . . . 0.0 111.692 169.5 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.413 HG13 HD13 ' A' ' 14' ' ' ILE . 12.4 p -76.63 -26.23 16.43 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 C-N-CA 123.43 0.692 . . . . 0.0 109.932 -174.932 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.529 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 60.3 mt -61.52 -46.69 96.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 167.829 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.403 ' HA ' ' HG3' ' A' ' 36' ' ' ARG . 0.4 OUTLIER -54.84 -38.98 68.09 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 119.291 0.951 . . . . 0.0 112.285 171.062 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -67.7 -39.43 84.38 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 118.771 0.714 . . . . 0.0 110.478 178.796 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.568 HD13 ' CE1' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -66.55 -27.08 67.47 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 124.932 1.293 . . . . 0.0 109.003 175.918 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.403 ' HG3' ' HA ' ' A' ' 33' ' ' GLN . 7.9 mmt-85 -70.79 -48.79 52.39 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 176.315 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 28.1 mmtp -60.91 -31.24 70.76 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 123.575 0.547 . . . . 0.0 111.363 177.834 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 43.1 t -67.06 -58.79 4.24 Favored 'General case' 0 N--CA 1.44 -0.964 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 168.455 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 38.8 t -61.52 -39.58 91.54 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 121.115 -0.991 . . . . 0.0 113.17 -169.173 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.47 -2.02 12.62 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 -175.605 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.563 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 12.1 tt0 -94.63 -7.21 41.54 Favored 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 127.43 2.292 . . . . 0.0 111.448 -171.086 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.563 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 78.4 m-85 -138.77 161.18 59.78 Favored Pre-proline 0 N--CA 1.447 -0.602 0 C-N-CA 124.445 1.098 . . . . 0.0 112.063 -167.877 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -67.79 121.03 8.05 Favored 'Trans proline' 0 N--CA 1.456 -0.713 0 N-CA-C 104.792 -2.811 . . . . 0.0 104.792 164.436 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.9 mmtt -51.35 -33.06 27.94 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 -166.025 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.88 -14.89 32.62 Favored Glycine 0 CA--C 1.533 1.18 0 C-N-CA 124.334 0.969 . . . . 0.0 113.913 176.313 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.9 tpm_? -57.12 -31.45 65.32 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 125.32 1.448 . . . . 0.0 111.247 169.446 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.6 t -136.64 134.8 37.71 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-O 123.372 1.558 . . . . 0.0 112.62 -168.781 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 15.6 t -68.91 -54.04 22.78 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.699 0 CA-C-N 112.789 -2.005 . . . . 0.0 108.425 177.044 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 5.1 m -60.72 -43.5 95.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.47 0 CA-C-O 118.241 -0.885 . . . . 0.0 109.814 -177.969 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 43.4 t -63.11 -32.05 73.34 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.427 1.491 . . . . 0.0 110.284 179.949 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.2 m -68.81 -27.72 66.11 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.059 0.544 . . . . 0.0 111.079 172.108 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.99 -35.17 78.22 Favored Glycine 0 C--N 1.345 1.031 0 CA-C-O 123.794 1.774 . . . . 0.0 111.525 167.357 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.568 ' CE1' HD13 ' A' ' 35' ' ' LEU . 1.5 t80 -80.78 -40.34 25.27 Favored 'General case' 0 N--CA 1.415 -2.216 0 N-CA-C 117.162 2.282 . . . . 0.0 117.162 -162.687 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 . . . . . 0 C--N 1.321 -0.634 0 CA-C-O 118.64 -0.695 . . . . 0.0 110.337 169.527 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.0 t0 . . . . . 0 N--CA 1.445 -0.723 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -59.04 -18.3 42.6 Favored 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 124.827 3.685 . . . . 0.0 115.053 -172.354 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 65.5 m -110.55 -8.49 14.63 Favored 'General case' 0 N--CA 1.438 -1.069 0 C-N-CA 126.888 2.075 . . . . 0.0 113.206 -168.473 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 18.5 tp60 -66.54 -23.97 66.3 Favored 'General case' 0 N--CA 1.445 -0.717 0 O-C-N 121.916 -0.49 . . . . 0.0 111.987 -173.258 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -69.07 -45.09 71.21 Favored 'General case' 0 C--O 1.225 -0.191 0 CA-C-O 121.827 0.822 . . . . 0.0 110.069 174.433 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.9 mp0 -65.74 -40.75 92.44 Favored 'General case' 0 N--CA 1.443 -0.807 0 C-N-CA 127.317 2.247 . . . . 0.0 108.098 -175.318 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.66 -44.43 73.28 Favored 'General case' 0 C--N 1.341 0.225 0 C-N-CA 125.474 1.51 . . . . 0.0 112.504 168.556 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 70.9 m -59.27 -43.87 92.47 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 110.424 -0.213 . . . . 0.0 110.424 175.399 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -63.96 -21.02 66.3 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 117.584 -1.198 . . . . 0.0 112.518 178.73 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 26.3 mm -59.75 -54.97 27.22 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.193 0 CA-C-N 120.587 1.54 . . . . 0.0 108.942 171.788 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -57.61 -54.25 49.03 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 115.163 -0.926 . . . . 0.0 108.848 178.343 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 57.2 mmtt -68.57 -30.64 69.45 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 118.567 -1.253 . . . . 0.0 111.592 -172.757 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 19.9 t -56.82 -48.85 77.05 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 168.789 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.76 -46.81 84.01 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 123.099 0.56 . . . . 0.0 110.477 179.55 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -57.22 -45.96 83.37 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.708 0.803 . . . . 0.0 111.267 174.204 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.85 -12.78 57.03 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 175.387 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -124.21 8.6 8.54 Favored 'General case' 0 C--N 1.342 0.264 0 C-N-CA 124.592 1.157 . . . . 0.0 112.29 -172.524 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 58.6 40.1 23.96 Favored 'General case' 0 C--N 1.345 0.389 0 CA-C-O 122.414 1.102 . . . . 0.0 110.846 179.42 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.264 7.1 m-85 72.09 13.88 5.77 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 127.849 2.459 . . . . 0.0 114.612 168.72 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 66.0 mtm -69.83 85.84 0.5 Allowed 'General case' 0 N--CA 1.441 -0.91 0 C-N-CA 125.063 1.345 . . . . 0.0 110.107 170.148 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -53.9 -24.47 16.24 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.505 0.722 . . . . 0.0 111.698 170.643 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.1 m -53.65 -40.56 65.97 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 126.299 1.839 . . . . 0.0 112.335 170.631 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.4 mmtm -71.85 -47.28 54.15 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 124.201 1.0 . . . . 0.0 108.754 174.132 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 70.9 m -74.22 4.29 5.93 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 124.78 1.232 . . . . 0.0 113.418 -173.626 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 59.4 mm-40 -54.9 -32.29 60.89 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 119.131 0.878 . . . . 0.0 109.894 166.846 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.96 -53.0 63.0 Favored 'General case' 0 C--N 1.345 0.39 0 C-N-CA 124.582 1.153 . . . . 0.0 111.676 174.709 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.7 p -77.54 -27.15 15.46 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.78 0 C-N-CA 123.439 0.696 . . . . 0.0 110.027 -174.296 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.529 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 53.7 mt -63.18 -44.03 99.13 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 168.581 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -57.92 -29.74 65.37 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 118.966 0.803 . . . . 0.0 111.768 173.193 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -70.17 -47.5 61.34 Favored 'General case' 0 N--CA 1.443 -0.822 0 CA-C-N 118.69 0.677 . . . . 0.0 111.557 173.458 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.471 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.7 mt -61.9 -31.6 71.91 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 118.958 0.799 . . . . 0.0 110.239 176.759 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.73 -59.72 4.96 Favored 'General case' 0 CA--C 1.52 -0.208 0 C-N-CA 125.948 1.699 . . . . 0.0 109.956 175.2 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -63.47 -34.79 78.55 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 114.715 -1.13 . . . . 0.0 110.922 -177.256 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 42.8 t -62.22 -51.64 66.97 Favored 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 169.726 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 52.5 t -64.36 -48.73 74.41 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 123.7 0.8 . . . . 0.0 112.003 -170.173 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.85 -1.3 5.28 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 124.216 1.006 . . . . 0.0 112.339 -175.707 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.488 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 2.2 tp-100 -81.32 -8.22 59.71 Favored 'General case' 0 N--CA 1.437 -1.085 0 C-N-CA 125.005 1.322 . . . . 0.0 111.288 175.033 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.488 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 82.0 m-85 -142.04 160.4 55.52 Favored Pre-proline 0 N--CA 1.443 -0.818 0 C-N-CA 125.015 1.326 . . . . 0.0 111.907 -167.438 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -69.37 124.95 11.76 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 N-CA-C 105.641 -2.484 . . . . 0.0 105.641 165.234 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -47.11 -35.75 7.5 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 116.205 1.928 . . . . 0.0 116.205 -166.947 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.9 -14.56 17.06 Favored Glycine 0 CA--C 1.534 1.265 0 C-N-CA 124.515 1.055 . . . . 0.0 114.051 177.946 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 9.0 tpm_? -54.83 -28.46 49.82 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 126.401 1.88 . . . . 0.0 112.348 168.62 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.0 t -149.69 140.37 22.61 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-O 122.623 1.202 . . . . 0.0 111.531 -168.968 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 10.5 t -69.47 -54.24 20.67 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.691 0 CA-C-N 114.019 -1.446 . . . . 0.0 108.617 178.028 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.5 m -61.07 -40.49 85.85 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 C-N-CA 122.916 0.486 . . . . 0.0 110.334 -177.542 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . 0.475 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 12.6 t -67.1 -36.04 81.07 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.716 1.206 . . . . 0.0 109.905 177.473 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 53.3 m -65.51 -27.59 68.58 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 121.773 -0.579 . . . . 0.0 110.873 172.476 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -71.14 -27.91 71.12 Favored Glycine 0 C--N 1.345 1.047 0 CA-C-O 122.125 0.847 . . . . 0.0 112.06 169.425 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.529 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 0.2 OUTLIER -80.95 -47.66 13.37 Favored 'General case' 0 N--CA 1.428 -1.574 0 C-N-CA 125.727 1.611 . . . . 0.0 114.801 -166.965 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 . . . . . 0 CA--C 1.54 0.593 0 C-N-CA 119.517 -0.873 . . . . 0.0 110.152 173.626 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 36.6 t0 . . . . . 0 CA--C 1.537 0.464 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_exo -60.57 -31.34 92.18 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 123.599 2.866 . . . . 0.0 112.781 -171.809 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.414 ' HB3' ' CD2' ' A' ' 35' ' ' LEU . 77.7 m -94.25 -13.17 26.82 Favored 'General case' 0 N--CA 1.438 -1.069 0 C-N-CA 125.194 1.398 . . . . 0.0 112.558 -169.45 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.0 tp60 -61.7 -25.23 67.29 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 123.131 0.572 . . . . 0.0 110.855 177.804 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.8 tttm -60.14 -56.58 19.83 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.824 1.25 . . . . 0.0 109.962 168.118 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -62.99 -36.97 85.3 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.355 0.662 . . . . 0.0 110.568 -177.992 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.63 -43.95 72.75 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 124.854 1.262 . . . . 0.0 112.214 169.388 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 80.8 m -57.93 -43.5 86.32 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 121.174 -0.21 . . . . 0.0 110.965 172.96 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -63.61 -23.56 67.43 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-O 117.751 -1.119 . . . . 0.0 112.491 178.728 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 26.4 mm -59.36 -54.72 30.39 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.226 0 CA-C-N 120.128 1.331 . . . . 0.0 108.833 172.531 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 33.0 mm-40 -59.2 -53.07 62.49 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.422 179.467 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.34 -33.08 74.93 Favored 'General case' 0 C--N 1.333 -0.111 0 C-N-CA 118.703 -1.199 . . . . 0.0 111.568 -175.811 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 23.6 t -56.1 -47.68 77.59 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 119.271 0.941 . . . . 0.0 108.944 169.329 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.07 -46.83 84.78 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 123.516 0.727 . . . . 0.0 110.682 178.8 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -57.4 -43.83 84.05 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.72 0.808 . . . . 0.0 111.305 173.782 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.5 -11.96 59.19 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.076 0.95 . . . . 0.0 113.477 174.631 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 -125.66 8.63 7.62 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 124.719 1.208 . . . . 0.0 112.358 -172.029 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.1 m 58.56 40.17 24.0 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-N 119.494 1.043 . . . . 0.0 110.903 179.78 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.257 6.9 m-85 71.71 13.34 6.24 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 127.654 2.382 . . . . 0.0 114.779 168.614 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 64.4 mtm -70.17 84.61 0.54 Allowed 'General case' 0 N--CA 1.441 -0.892 0 C-N-CA 125.184 1.394 . . . . 0.0 109.722 170.082 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -54.63 -24.27 20.78 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 119.063 -0.494 . . . . 0.0 111.637 172.335 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.8 m -51.77 -44.05 63.22 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 126.452 1.901 . . . . 0.0 112.141 170.076 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.4 mmtm -67.75 -48.49 66.26 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 124.175 0.99 . . . . 0.0 108.687 174.651 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.422 ' O ' HG12 ' A' ' 31' ' ' VAL . 73.2 m -72.73 2.71 6.1 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 124.973 1.309 . . . . 0.0 113.302 -174.748 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 45.9 mm-40 -56.3 -26.64 52.82 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 120.078 1.308 . . . . 0.0 111.281 168.159 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.34 -51.38 69.64 Favored 'General case' 0 C--N 1.345 0.392 0 C-N-CA 125.537 1.535 . . . . 0.0 112.184 169.951 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.422 HG12 ' O ' ' A' ' 28' ' ' CYS . 9.7 p -80.71 -26.09 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.888 0 C-N-CA 123.698 0.799 . . . . 0.0 109.657 -174.759 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.5 mp -60.51 -48.52 88.15 Favored 'Isoleucine or valine' 0 C--N 1.35 0.593 0 N-CA-C 105.689 -1.967 . . . . 0.0 105.689 166.214 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.454 ' HA ' ' HG2' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -52.98 -37.63 61.48 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 123.212 0.605 . . . . 0.0 110.886 176.514 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -70.91 -39.49 72.69 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 120.072 -0.651 . . . . 0.0 110.974 179.669 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.549 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.0 OUTLIER -64.4 -36.83 85.41 Favored 'General case' 0 C--N 1.342 0.279 0 CA-C-O 117.877 -1.059 . . . . 0.0 110.765 174.663 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.454 ' HG2' ' HA ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -68.12 -40.5 82.51 Favored 'General case' 0 C--N 1.341 0.219 0 CA-C-N 119.775 1.17 . . . . 0.0 110.215 178.347 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 57.2 mttp -63.49 -39.55 94.73 Favored 'General case' 0 C--N 1.341 0.218 0 CA-C-O 119.232 -0.413 . . . . 0.0 111.012 175.536 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.1 t -59.33 -52.74 64.34 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 171.937 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.1 t -57.74 -48.87 78.4 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 124.034 0.934 . . . . 0.0 112.048 -171.663 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.12 -1.25 7.26 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.241 -0.89 . . . . 0.0 112.722 -175.148 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.539 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 21.2 tt0 -84.15 -12.09 55.52 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 125.203 1.401 . . . . 0.0 111.345 179.088 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.539 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 76.4 m-85 -133.02 157.87 77.26 Favored Pre-proline 0 N--CA 1.447 -0.617 0 C-N-CA 124.174 0.99 . . . . 0.0 112.003 -168.146 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -67.31 109.43 1.78 Allowed 'Trans proline' 0 N--CA 1.453 -0.898 0 N-CA-C 104.878 -2.778 . . . . 0.0 104.878 165.501 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.88 -27.48 0.53 Allowed 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 117.199 2.296 . . . . 0.0 117.199 -166.773 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.47 -18.44 29.92 Favored Glycine 0 CA--C 1.536 1.369 0 CA-C-N 119.512 1.051 . . . . 0.0 113.571 172.479 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.26 -21.19 63.67 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.946 2.098 . . . . 0.0 112.516 170.93 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.6 t -148.06 134.59 19.75 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 123.566 1.651 . . . . 0.0 114.152 -170.434 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.8 t -72.43 -55.33 13.52 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.638 0 CA-C-N 112.552 -2.113 . . . . 0.0 108.886 178.017 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 5.9 m -59.2 -40.88 82.21 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 C-N-CA 122.684 0.394 . . . . 0.0 110.029 -179.178 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . 0.452 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 13.3 t -63.78 -37.57 87.88 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.524 1.13 . . . . 0.0 109.713 178.021 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 52.7 m -67.64 -17.11 64.49 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 118.727 -0.654 . . . . 0.0 112.319 175.035 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -86.04 -20.57 55.1 Favored Glycine 0 C--N 1.344 0.991 0 CA-C-N 119.148 0.886 . . . . 0.0 112.205 167.776 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.549 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -80.21 -43.13 22.0 Favored 'General case' 0 N--CA 1.418 -2.052 0 N-CA-C 113.959 1.096 . . . . 0.0 113.959 -166.269 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 . . . . . 0 C--N 1.319 -0.752 0 O-C-N 123.975 0.797 . . . . 0.0 110.68 179.916 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 46.1 t0 . . . . . 0 CA--C 1.539 0.524 0 CA-C-O 119.183 -0.437 . . . . 0.0 111.814 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -63.85 -28.42 67.51 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 123.646 2.897 . . . . 0.0 112.671 -175.509 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 13.1 m -91.44 -8.1 48.75 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 123.418 0.687 . . . . 0.0 112.145 -176.927 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 20.1 tp60 -63.48 -25.04 68.08 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 119.13 0.877 . . . . 0.0 110.527 -179.514 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -60.04 -52.32 65.89 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.506 1.122 . . . . 0.0 109.589 169.454 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -65.37 -38.71 90.89 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.616 -0.678 . . . . 0.0 110.244 -179.442 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -59.97 -35.4 74.92 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.136 0.974 . . . . 0.0 112.522 172.329 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 95.6 m -65.13 -43.55 91.55 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.229 0.468 . . . . 0.0 110.936 169.207 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 -62.75 -25.54 68.25 Favored 'General case' 0 C--O 1.225 -0.232 0 CA-C-O 117.725 -1.131 . . . . 0.0 112.221 178.367 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 45.2 mm -56.72 -50.3 74.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-N 120.187 1.358 . . . . 0.0 109.439 169.56 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 44.9 mm-40 -60.68 -54.32 46.74 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 -175.729 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 27.0 mttm -70.53 -30.92 67.8 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 118.56 -0.733 . . . . 0.0 111.623 -173.29 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 21.5 t -56.98 -46.0 82.52 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 107.934 -1.136 . . . . 0.0 107.934 168.666 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.0 -43.9 91.58 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-O 118.297 -0.859 . . . . 0.0 110.372 179.722 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -58.51 -46.51 86.6 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 119.475 1.034 . . . . 0.0 111.129 173.07 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.42 -15.28 60.3 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 175.953 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.3 m-80 -122.81 11.05 9.65 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.925 1.29 . . . . 0.0 111.43 -172.931 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.9 m 55.98 40.74 30.36 Favored 'General case' 0 C--N 1.346 0.44 0 CA-C-O 122.556 1.17 . . . . 0.0 110.817 177.315 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.253 6.7 m-85 71.85 12.59 6.17 Favored 'General case' 0 N--CA 1.444 -0.758 0 C-N-CA 128.466 2.706 . . . . 0.0 114.068 169.713 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 62.0 mtm -73.26 83.99 1.38 Allowed 'General case' 0 N--CA 1.437 -1.123 0 C-N-CA 125.445 1.498 . . . . 0.0 109.159 172.214 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -53.46 -24.01 11.68 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.022 0.929 . . . . 0.0 111.465 172.115 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.1 m -51.88 -41.29 61.78 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 126.131 1.773 . . . . 0.0 112.307 169.988 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 56.8 mttt -76.69 -42.5 41.35 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.234 0.614 . . . . 0.0 109.753 175.779 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.8 m -70.98 0.73 6.79 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 124.193 0.997 . . . . 0.0 113.275 -178.7 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 82.3 mm-40 -55.25 -27.44 46.44 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 119.935 1.243 . . . . 0.0 110.823 167.114 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.07 -60.57 3.54 Favored 'General case' 0 C--N 1.345 0.401 0 C-N-CA 125.637 1.575 . . . . 0.0 111.467 171.46 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.6 p -70.93 -29.46 37.38 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.694 0 C-N-CA 123.635 0.774 . . . . 0.0 109.979 -174.437 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.518 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 70.3 mt -58.63 -52.7 56.66 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 N-CA-C 105.869 -1.9 . . . . 0.0 105.869 168.842 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -58.79 -30.07 67.3 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 119.48 1.036 . . . . 0.0 113.187 175.921 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -71.27 -37.67 71.89 Favored 'General case' 0 N--CA 1.438 -1.072 0 C-N-CA 119.833 -0.747 . . . . 0.0 109.724 176.62 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.517 HD13 ' CE1' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -63.42 -30.74 71.82 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 124.811 1.244 . . . . 0.0 108.916 172.289 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.2 mmt85 -70.35 -49.58 47.84 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 -179.952 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 46.1 mttp -61.71 -36.57 81.29 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 124.257 1.023 . . . . 0.0 111.156 177.13 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 42.7 t -60.45 -54.04 50.27 Favored 'General case' 0 C--O 1.221 -0.429 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 169.357 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 51.5 t -61.49 -44.27 97.39 Favored 'General case' 0 CA--C 1.515 -0.379 0 C-N-CA 124.477 1.111 . . . . 0.0 112.202 -169.6 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.45 -3.14 16.31 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.18 -0.918 . . . . 0.0 113.112 -178.354 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.444 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 2.5 tp-100 -88.63 -2.48 58.62 Favored 'General case' 0 N--CA 1.439 -0.999 0 C-N-CA 124.219 1.008 . . . . 0.0 111.361 -175.783 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.444 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 63.2 m-85 -143.13 162.88 40.83 Favored Pre-proline 0 N--CA 1.443 -0.804 0 C-N-CA 127.364 2.266 . . . . 0.0 110.795 -168.882 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_exo -61.33 116.97 3.74 Favored 'Trans proline' 0 N--CA 1.456 -0.699 0 N-CA-C 105.706 -2.459 . . . . 0.0 105.706 166.231 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -51.84 -35.36 44.31 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 120.498 1.499 . . . . 0.0 114.655 -168.929 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -70.26 -4.61 51.13 Favored Glycine 0 CA--C 1.531 1.089 0 CA-C-O 118.258 -1.301 . . . . 0.0 114.143 178.395 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.97 -7.18 32.78 Favored 'General case' 0 CA--C 1.554 1.104 0 CA-C-N 120.044 1.922 . . . . 0.0 111.86 174.508 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.7 t -141.17 155.32 46.09 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 126.162 1.785 . . . . 0.0 110.404 -168.392 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 47.9 t -79.2 -60.92 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.562 0 C-N-CA 124.876 1.27 . . . . 0.0 108.801 171.197 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.5 m -60.37 -44.31 95.71 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 CA-C-O 119.073 -0.489 . . . . 0.0 110.044 -169.631 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 31.7 t -65.64 -29.39 69.96 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.177 1.391 . . . . 0.0 110.23 -179.737 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 69.6 m -69.68 -21.62 63.5 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 118.533 -0.746 . . . . 0.0 111.307 171.796 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -75.51 -39.23 35.82 Favored Glycine 0 C--N 1.344 1.009 0 CA-C-O 124.474 2.152 . . . . 0.0 110.681 166.976 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.518 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 1.1 t80 -76.69 -38.73 53.94 Favored 'General case' 0 N--CA 1.419 -1.998 0 CA-C-N 111.819 -2.19 . . . . 0.0 116.705 -163.721 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 . . . . . 0 C--N 1.322 -0.6 0 CA-C-O 118.643 -0.694 . . . . 0.0 110.954 169.731 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.5 mtt . . . . . 0 CA--C 1.54 0.584 0 N-CA-C 111.705 0.261 . . . . 0.0 111.705 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -76.45 60.47 6.48 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 123.961 3.107 . . . . 0.0 109.491 169.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 30.8 mm-40 -143.75 -176.26 4.91 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 129.125 2.97 . . . . 0.0 107.856 -174.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -57.52 114.28 2.16 Favored 'General case' 0 C--N 1.341 0.235 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 169.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 36.0 t0 -95.13 105.92 22.53 Favored Pre-proline 0 N--CA 1.446 -0.647 0 C-N-CA 127.428 2.291 . . . . 0.0 107.776 -176.261 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -55.91 -33.93 90.28 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 124.499 3.466 . . . . 0.0 113.068 -175.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.408 ' HB3' ' CD2' ' A' ' 35' ' ' LEU . 56.8 m -94.92 -13.2 25.61 Favored 'General case' 0 N--CA 1.435 -1.217 0 C-N-CA 125.815 1.646 . . . . 0.0 113.054 -169.165 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.6 tp60 -62.64 -25.94 68.37 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.695 0.68 . . . . 0.0 111.416 -177.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -61.21 -50.44 73.07 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.376 0.67 . . . . 0.0 110.195 172.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -64.47 -44.59 90.56 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 123.777 0.831 . . . . 0.0 109.149 179.268 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.59 -41.53 54.74 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 119.937 1.244 . . . . 0.0 113.035 174.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 84.6 m -56.56 -46.7 80.58 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 123.419 0.449 . . . . 0.0 110.128 174.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -60.28 -39.04 85.48 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 117.496 -1.24 . . . . 0.0 112.303 177.116 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 2.0 mp -59.16 -49.87 81.82 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 CA-C-N 120.451 1.478 . . . . 0.0 109.482 173.281 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 93.8 mm-40 -61.34 -51.35 69.18 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 -174.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 41.2 mtpt -68.89 -37.98 79.34 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 123.798 0.839 . . . . 0.0 111.945 -177.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 17.2 t -52.28 -46.45 65.87 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 169.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.57 -46.39 84.02 Favored 'General case' 0 N--CA 1.442 -0.856 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 -177.075 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.435 ' HA ' ' CE1' ' A' ' 23' ' ' TYR . 3.1 mm-40 -63.15 -44.2 96.2 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 118.999 0.818 . . . . 0.0 110.637 179.265 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -60.95 -14.11 20.49 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 113.193 0.812 . . . . 0.0 113.193 172.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 57.9 m-80 -122.34 11.51 10.04 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.59 1.556 . . . . 0.0 111.123 -177.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 12.6 m 51.6 43.31 29.86 Favored 'General case' 0 C--N 1.346 0.447 0 C-N-CA 125.026 1.33 . . . . 0.0 112.011 -179.256 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.435 ' CE1' ' HA ' ' A' ' 19' ' ' GLN 0.271 7.4 m-85 73.49 14.26 4.38 Favored 'General case' 0 N--CA 1.441 -0.891 0 C-N-CA 129.14 2.976 . . . . 0.0 113.976 169.145 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 64.7 mtm -69.88 85.03 0.49 Allowed 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 125.37 1.468 . . . . 0.0 110.351 170.057 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -55.33 -17.6 5.04 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 127.115 2.166 . . . . 0.0 111.179 168.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 68.8 m -60.75 -54.06 49.86 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.76 1.624 . . . . 0.0 110.346 168.136 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 57.6 mttt -67.3 -43.29 82.07 Favored 'General case' 0 C--O 1.231 0.128 0 O-C-N 121.799 -0.563 . . . . 0.0 109.846 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.5 m -71.09 2.69 4.19 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 117.234 -1.365 . . . . 0.0 113.164 175.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 59.0 mm-40 -53.6 -34.24 57.73 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 121.022 1.737 . . . . 0.0 111.432 169.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.08 -56.42 22.49 Favored 'General case' 0 C--N 1.342 0.271 0 CA-C-N 119.271 0.941 . . . . 0.0 111.308 177.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.9 p -73.21 -33.22 40.99 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.025 -174.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 35.9 mt -59.25 -44.05 91.18 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.467 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 170.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.54 -34.71 62.24 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 118.332 0.515 . . . . 0.0 111.172 173.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -72.09 -40.17 68.41 Favored 'General case' 0 N--CA 1.427 -1.581 0 C-N-CA 118.536 -1.266 . . . . 0.0 111.158 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.492 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.5 mt -65.01 -30.5 71.49 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 119.903 1.229 . . . . 0.0 111.75 173.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.95 -58.23 9.46 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 124.053 0.941 . . . . 0.0 108.879 174.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.48 -35.62 76.34 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 114.15 -1.386 . . . . 0.0 111.11 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 49.6 t -62.27 -50.11 72.99 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 123.52 0.728 . . . . 0.0 109.288 172.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 53.1 t -64.05 -48.07 77.72 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 123.905 0.882 . . . . 0.0 111.671 -172.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.408 ' HA ' ' HE3' ' A' ' 44' ' ' LYS . . . -67.45 -2.98 7.21 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 124.434 1.093 . . . . 0.0 112.706 -178.167 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.444 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 2.6 tp-100 -83.5 -5.87 59.29 Favored 'General case' 0 N--CA 1.439 -1.015 0 C-N-CA 124.87 1.268 . . . . 0.0 111.414 179.096 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.444 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 82.6 m-85 -138.81 161.83 56.15 Favored Pre-proline 0 N--CA 1.444 -0.767 0 C-N-CA 125.415 1.486 . . . . 0.0 110.508 -169.045 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -67.73 107.95 1.56 Allowed 'Trans proline' 0 N--CA 1.457 -0.664 0 N-CA-C 104.518 -2.916 . . . . 0.0 104.518 165.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.408 ' HE3' ' HA ' ' A' ' 40' ' ' ALA . 31.6 mmtm -38.08 -43.29 0.73 Allowed 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 117.04 2.237 . . . . 0.0 117.04 -163.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.19 -14.33 11.54 Favored Glycine 0 CA--C 1.537 1.429 0 C-N-CA 124.475 1.036 . . . . 0.0 114.109 177.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 29.1 tpt85 -48.83 -34.11 11.81 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 128.285 2.634 . . . . 0.0 112.168 170.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.3 t -138.78 140.86 38.76 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-O 121.939 0.876 . . . . 0.0 110.301 -169.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 11.8 t -69.52 -53.29 25.52 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 CA-C-N 114.413 -1.267 . . . . 0.0 108.823 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 5.0 m -61.88 -38.9 81.71 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 CA-C-O 119.297 -0.382 . . . . 0.0 110.248 -178.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . 0.474 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 10.2 t -66.27 -38.31 87.51 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.915 0.886 . . . . 0.0 109.799 176.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.4 m -65.24 -21.07 66.69 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 118.803 -0.618 . . . . 0.0 111.309 173.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -79.01 -25.97 58.95 Favored Glycine 0 C--N 1.343 0.958 0 CA-C-O 122.173 0.874 . . . . 0.0 112.34 168.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.492 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -80.41 -44.85 18.65 Favored 'General case' 0 N--CA 1.429 -1.503 0 N-CA-C 114.85 1.426 . . . . 0.0 114.85 -165.642 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -64.19 -24.12 67.56 Favored 'General case' 0 C--N 1.319 -0.744 0 O-C-N 123.546 0.528 . . . . 0.0 110.425 173.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -73.43 -43.27 60.75 Favored 'General case' 0 C--N 1.346 0.422 0 O-C-N 121.398 -0.814 . . . . 0.0 110.217 168.186 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.45 -40.94 88.44 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.547 0.739 . . . . 0.0 110.901 175.06 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -59.79 -49.26 78.42 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 125.383 1.473 . . . . 0.0 109.257 175.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -56.3 -47.74 78.06 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-O 118.068 -0.968 . . . . 0.0 110.027 172.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -55.05 -48.4 73.5 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 119.308 0.958 . . . . 0.0 110.851 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -66.32 -30.53 70.96 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.009 0.924 . . . . 0.0 111.371 -178.559 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 39.5 mt -78.22 -42.47 31.21 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.823 1.249 . . . . 0.0 109.065 -179.314 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -56.84 -42.64 80.02 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.887 1.675 . . . . 0.0 109.95 169.117 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 39.6 ttp180 -70.48 -17.38 62.97 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.95 1.3 . . . . 0.0 112.256 176.328 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 55.19 24.94 6.72 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 128.203 2.601 . . . . 0.0 113.22 169.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 64.0 p -168.08 160.86 12.23 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 123.777 0.831 . . . . 0.0 110.531 -169.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -78.5 27.63 0.21 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.216 1.407 . . . . 0.0 112.512 169.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 43.1 m -64.08 177.9 0.74 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.758 1.623 . . . . 0.0 111.07 175.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 64.5 tttm . . . . . 0 C--N 1.343 0.313 0 C-N-CA 124.057 0.943 . . . . 0.0 108.994 -170.098 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.3 ptm . . . . . 0 N--CA 1.445 -0.711 0 CA-C-O 118.375 -0.821 . . . . 0.0 108.904 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -67.08 110.41 1.96 Allowed 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 122.41 2.073 . . . . 0.0 108.411 168.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -74.59 172.33 12.23 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.107 0.963 . . . . 0.0 110.059 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 43.9 tttm -68.78 30.79 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.529 1.932 . . . . 0.0 112.515 171.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 27.2 t0 -97.73 103.71 17.99 Favored Pre-proline 0 N--CA 1.444 -0.744 0 C-N-CA 128.361 2.664 . . . . 0.0 109.245 -171.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -55.94 -29.44 73.23 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 123.68 2.92 . . . . 0.0 113.572 -176.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 99.1 m -102.27 -8.78 20.97 Favored 'General case' 0 N--CA 1.438 -1.057 0 C-N-CA 125.857 1.663 . . . . 0.0 113.974 -168.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.1 tt0 -62.96 -26.0 68.63 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 123.454 0.702 . . . . 0.0 111.327 -179.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.9 tmtt? -61.34 -53.23 59.34 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.45 1.1 . . . . 0.0 109.977 169.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -63.61 -43.96 95.38 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.714 0.806 . . . . 0.0 109.866 -178.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -51.05 -42.03 60.26 Favored 'General case' 0 C--N 1.341 0.217 0 C-N-CA 125.227 1.411 . . . . 0.0 112.773 169.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 79.7 m -63.23 -43.53 97.82 Favored 'General case' 0 C--O 1.234 0.239 0 O-C-N 123.166 0.291 . . . . 0.0 111.114 174.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 57.1 mm-40 -59.52 -32.93 70.75 Favored 'General case' 0 C--N 1.342 0.28 0 CA-C-O 118.325 -0.845 . . . . 0.0 111.529 177.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.626 HD13 HG22 ' A' ' 31' ' ' VAL . 10.6 mm -58.42 -44.63 89.12 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.143 0 CA-C-N 119.519 1.054 . . . . 0.0 110.561 174.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 63.8 mm-40 -64.68 -51.13 64.11 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 -169.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.0 tmtt? -67.52 -39.54 85.1 Favored 'General case' 0 N--CA 1.442 -0.862 0 C-N-CA 127.536 2.334 . . . . 0.0 111.407 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 15.3 t -52.37 -44.97 65.58 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 170.151 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.8 -44.88 93.74 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-O 118.826 -0.607 . . . . 0.0 109.951 -178.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.416 ' HA ' ' CE1' ' A' ' 23' ' ' TYR . 4.9 mm-40 -65.44 -41.34 93.58 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 119.243 0.928 . . . . 0.0 110.65 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.75 -11.87 14.21 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.069 0.948 . . . . 0.0 113.102 171.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 57.8 m-80 -125.35 10.09 7.95 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.085 1.354 . . . . 0.0 112.142 -176.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 13.1 m 53.43 42.36 32.0 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-O 122.723 1.249 . . . . 0.0 112.003 -178.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.416 ' CE1' ' HA ' ' A' ' 19' ' ' GLN 0.259 6.5 m-85 73.34 13.26 4.66 Favored 'General case' 0 N--CA 1.444 -0.749 0 C-N-CA 128.431 2.692 . . . . 0.0 114.486 168.504 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 68.7 mtm -69.86 84.8 0.49 Allowed 'General case' 0 N--CA 1.441 -0.922 0 C-N-CA 124.876 1.27 . . . . 0.0 109.725 169.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -53.34 -25.1 13.83 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.828 0.851 . . . . 0.0 111.337 170.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.5 m -51.16 -40.47 58.67 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 126.631 1.972 . . . . 0.0 112.587 170.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 54.2 mmtt -74.52 -47.9 30.24 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.358 1.063 . . . . 0.0 108.8 175.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 82.3 m -71.65 3.21 4.22 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.905 1.282 . . . . 0.0 113.224 -176.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 41.3 mm-40 -54.8 -32.9 60.81 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 119.488 1.04 . . . . 0.0 110.151 167.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.99 -58.89 6.17 Favored 'General case' 0 C--N 1.345 0.408 0 C-N-CA 124.977 1.311 . . . . 0.0 111.333 175.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.626 HG22 HD13 ' A' ' 14' ' ' ILE . 10.6 p -69.85 -32.27 51.27 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 C-N-CA 124.013 0.925 . . . . 0.0 109.761 -174.206 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.416 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 72.4 mt -60.42 -48.28 89.02 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 N-CA-C 107.106 -1.442 . . . . 0.0 107.106 170.156 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.421 ' HA ' ' HG3' ' A' ' 36' ' ' ARG . 1.6 tp-100 -59.26 -20.39 53.84 Favored 'General case' 0 N--CA 1.439 -0.976 0 O-C-N 121.08 -1.013 . . . . 0.0 112.692 175.589 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.3 tp10 -80.36 -34.93 36.13 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 120.366 1.439 . . . . 0.0 111.83 169.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.477 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.9 mt -58.82 -27.13 64.8 Favored 'General case' 0 C--N 1.345 0.399 0 CA-C-N 120.298 1.408 . . . . 0.0 109.456 172.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.421 ' HG3' ' HA ' ' A' ' 33' ' ' GLN . 18.3 mmt85 -64.17 -52.22 60.02 Favored 'General case' 0 CA--C 1.52 -0.206 0 C-N-CA 123.915 0.886 . . . . 0.0 109.487 176.362 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -67.99 -28.09 67.13 Favored 'General case' 0 C--O 1.235 0.304 0 O-C-N 123.572 0.545 . . . . 0.0 111.036 -177.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 49.8 t -68.11 -53.0 28.59 Favored 'General case' 0 N--CA 1.438 -1.041 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 168.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 51.8 t -64.12 -50.53 67.9 Favored 'General case' 0 CA--C 1.515 -0.389 0 C-N-CA 124.33 1.052 . . . . 0.0 112.381 -169.332 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.93 0.95 3.81 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.708 0.803 . . . . 0.0 112.613 -173.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.564 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 9.5 tt0 -82.82 -11.17 58.45 Favored 'General case' 0 N--CA 1.439 -1.008 0 C-N-CA 126.721 2.008 . . . . 0.0 110.855 176.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.564 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 77.1 m-85 -139.92 162.02 52.79 Favored Pre-proline 0 N--CA 1.445 -0.677 0 C-N-CA 125.125 1.37 . . . . 0.0 111.877 -168.093 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.43 144.77 46.22 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 N-CA-C 107.692 -1.696 . . . . 0.0 107.692 166.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 55.3 tttp -52.23 -40.73 62.02 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 114.189 1.181 . . . . 0.0 114.189 -170.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -64.92 -7.63 30.81 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 124.016 0.817 . . . . 0.0 113.604 -179.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.3 tpm_? -70.33 -21.16 62.94 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 118.957 1.379 . . . . 0.0 111.61 172.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.8 t -150.69 135.18 17.17 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-O 122.982 1.372 . . . . 0.0 112.867 -169.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 13.4 t -67.43 -52.57 40.4 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 CA-C-N 113.39 -1.732 . . . . 0.0 108.449 175.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 3.1 m -64.28 -41.82 93.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 CA-C-O 118.321 -0.847 . . . . 0.0 109.923 -176.412 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . 0.42 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 43.9 t -64.53 -30.51 71.53 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.708 1.603 . . . . 0.0 110.019 177.219 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 48.9 m -67.01 -32.37 73.56 Favored 'General case' 0 CA--C 1.536 0.41 0 O-C-N 121.682 -0.636 . . . . 0.0 110.903 170.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.51 -33.36 84.44 Favored Glycine 0 C--N 1.344 0.985 0 CA-C-O 123.033 1.352 . . . . 0.0 111.397 168.193 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.477 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.7 OUTLIER -81.03 -45.35 16.69 Favored 'General case' 0 N--CA 1.423 -1.812 0 N-CA-C 115.785 1.772 . . . . 0.0 115.785 -165.695 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -62.87 -27.55 69.43 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 119.121 -0.466 . . . . 0.0 110.219 169.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 58.9 tptt -70.22 -39.54 75.07 Favored 'General case' 0 C--N 1.347 0.495 0 CA-C-N 119.025 0.83 . . . . 0.0 110.526 168.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -59.15 -41.67 88.89 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 118.846 0.748 . . . . 0.0 110.501 171.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -65.33 -40.64 93.96 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.161 0.984 . . . . 0.0 110.326 178.347 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -59.84 -43.04 94.81 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 118.228 0.467 . . . . 0.0 110.615 170.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -59.77 -38.87 83.04 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.234 0.614 . . . . 0.0 111.437 172.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -64.91 -34.84 79.35 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 117.975 -1.012 . . . . 0.0 111.142 178.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 92.0 mt -64.2 -14.91 58.49 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 118.787 0.721 . . . . 0.0 112.611 171.086 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 19.5 p -85.47 -48.95 8.48 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 119.909 1.231 . . . . 0.0 109.85 169.001 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 31.8 ttp180 -58.69 -66.21 0.53 Allowed 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 125.973 1.709 . . . . 0.0 110.368 -178.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -83.06 77.33 9.76 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 103.647 -2.723 . . . . 0.0 103.647 168.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 5.1 m -51.97 129.12 26.28 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 114.101 1.148 . . . . 0.0 114.101 -166.085 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -167.34 -161.87 0.43 Allowed 'General case' 0 N--CA 1.444 -0.736 0 C-N-CA 129.901 3.281 . . . . 0.0 106.478 -169.202 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 51.4 m -156.25 169.99 23.28 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 124.646 1.178 . . . . 0.0 108.672 168.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 58.6 tptt . . . . . 0 CA--C 1.53 0.183 0 C-N-CA 124.419 1.088 . . . . 0.0 110.596 -175.01 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.644 0 CA-C-O 119.214 -0.422 . . . . 0.0 111.343 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -64.87 119.38 6.4 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 123.512 2.808 . . . . 0.0 111.2 -173.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -152.71 -177.81 6.49 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 128.631 2.772 . . . . 0.0 107.355 -171.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 65.7 tttm -65.33 96.03 0.22 Allowed 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 166.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -94.94 99.32 4.1 Favored Pre-proline 0 C--N 1.324 -0.52 0 C-N-CA 127.141 2.176 . . . . 0.0 108.895 -171.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -56.68 -35.75 97.75 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 123.626 2.884 . . . . 0.0 112.211 -173.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 95.0 m -92.89 -7.96 44.7 Favored 'General case' 0 N--CA 1.442 -0.843 0 C-N-CA 126.246 1.818 . . . . 0.0 113.49 -168.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.6 tp60 -61.66 -24.78 66.96 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 117.966 0.348 . . . . 0.0 110.592 179.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 61.1 tttm -56.98 -60.01 4.21 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 125.209 1.404 . . . . 0.0 109.758 167.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 19.8 mp0 -57.81 -45.6 85.86 Favored 'General case' 0 C--O 1.225 -0.204 0 C-N-CA 123.88 0.872 . . . . 0.0 110.206 -176.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -52.54 -41.82 63.84 Favored 'General case' 0 C--N 1.338 0.096 0 C-N-CA 125.055 1.342 . . . . 0.0 112.697 173.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 92.4 m -61.69 -47.51 84.98 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 117.706 0.23 . . . . 0.0 110.609 172.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -62.21 -24.51 67.26 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-O 117.8 -1.095 . . . . 0.0 112.262 -179.102 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 35.8 mm -56.05 -53.4 39.12 Favored 'Isoleucine or valine' 0 C--N 1.343 0.29 0 CA-C-N 120.126 1.33 . . . . 0.0 109.624 172.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -58.73 -54.35 48.03 Favored 'General case' 0 N--CA 1.445 -0.68 0 O-C-N 124.025 0.828 . . . . 0.0 109.196 -179.484 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -66.7 -31.98 73.0 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 119.132 -1.027 . . . . 0.0 111.675 -174.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 20.4 t -56.48 -48.74 76.48 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 119.362 0.983 . . . . 0.0 108.681 169.23 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.05 -46.88 84.65 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 123.178 0.591 . . . . 0.0 110.429 179.461 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -56.98 -46.28 82.35 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.663 0.785 . . . . 0.0 111.258 174.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.59 -12.74 55.82 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.127 0.971 . . . . 0.0 113.475 175.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.3 m-80 -123.87 8.65 8.75 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.65 1.18 . . . . 0.0 112.149 -173.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 58.23 40.27 24.94 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 122.376 1.084 . . . . 0.0 110.873 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.262 7.1 m-85 71.97 14.08 5.87 Favored 'General case' 0 N--CA 1.444 -0.764 0 C-N-CA 127.876 2.47 . . . . 0.0 114.66 168.8 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 65.8 mtm -69.62 86.26 0.47 Allowed 'General case' 0 N--CA 1.443 -0.823 0 C-N-CA 125.147 1.379 . . . . 0.0 109.982 169.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -53.37 -25.87 17.14 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.414 0.686 . . . . 0.0 111.4 169.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.9 m -53.4 -38.66 63.63 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.834 2.054 . . . . 0.0 112.709 171.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.6 mmtm -73.98 -47.95 33.69 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 124.224 1.01 . . . . 0.0 108.58 173.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.2 m -73.09 2.7 6.6 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 124.753 1.221 . . . . 0.0 113.567 -173.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 27.1 mm-40 -54.49 -28.44 44.82 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 119.604 1.093 . . . . 0.0 110.08 167.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.73 -58.44 8.57 Favored 'General case' 0 C--N 1.348 0.504 0 C-N-CA 126.087 1.755 . . . . 0.0 111.955 172.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.6 p -72.59 -30.28 33.4 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 C-N-CA 123.873 0.869 . . . . 0.0 110.074 -174.002 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.512 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 75.9 mt -59.18 -48.76 85.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 N-CA-C 106.229 -1.767 . . . . 0.0 106.229 168.675 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.1 -25.8 59.38 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 121.014 -1.054 . . . . 0.0 113.454 174.048 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 49.6 tt0 -75.08 -39.78 60.55 Favored 'General case' 0 N--CA 1.434 -1.249 0 C-N-CA 119.353 -0.939 . . . . 0.0 110.486 174.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.463 ' HB3' ' CE2' ' A' ' 53' ' ' PHE . 3.4 mt -57.95 -31.92 67.31 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-O 117.863 -1.065 . . . . 0.0 109.304 169.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 19.1 mmt85 -66.19 -56.9 9.06 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 120.143 1.338 . . . . 0.0 109.145 -178.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 12.3 ptmm? -67.94 -22.19 65.06 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.651 -176.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.4 t -73.16 -51.92 16.07 Favored 'General case' 0 N--CA 1.439 -1.013 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 166.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 43.1 t -60.82 -52.27 65.79 Favored 'General case' 0 CA--C 1.514 -0.442 0 C-N-CA 124.404 1.082 . . . . 0.0 112.16 -170.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.16 1.67 4.5 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.382 -0.826 . . . . 0.0 112.554 -173.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.555 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 11.6 tt0 -85.29 -11.7 54.12 Favored 'General case' 0 N--CA 1.44 -0.944 0 C-N-CA 126.451 1.9 . . . . 0.0 111.168 -179.127 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.555 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 73.8 m-85 -135.37 160.48 67.8 Favored Pre-proline 0 N--CA 1.447 -0.623 0 C-N-CA 124.907 1.283 . . . . 0.0 111.168 -168.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -65.07 120.38 7.6 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 N-CA-C 105.416 -2.571 . . . . 0.0 105.416 165.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -43.79 -40.05 4.15 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 115.158 1.54 . . . . 0.0 115.158 -167.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.58 -9.71 14.18 Favored Glycine 0 CA--C 1.533 1.202 0 C-N-CA 124.845 1.212 . . . . 0.0 114.048 178.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.43 -26.65 68.83 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 119.06 1.43 . . . . 0.0 111.478 169.517 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 11.1 t -140.23 132.12 27.63 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-O 123.235 1.493 . . . . 0.0 112.727 -169.066 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 19.1 t -68.52 -52.06 40.25 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.655 0 CA-C-N 112.762 -2.017 . . . . 0.0 108.365 175.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 12.4 m -62.86 -41.86 94.23 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 CA-C-O 118.363 -0.827 . . . . 0.0 110.313 -176.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 29.3 t -63.66 -34.11 77.12 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.669 1.588 . . . . 0.0 110.183 176.161 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.9 m -67.65 -28.72 67.96 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 122.854 0.462 . . . . 0.0 110.708 171.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -67.89 -34.03 81.29 Favored Glycine 0 C--N 1.346 1.107 0 CA-C-O 123.15 1.417 . . . . 0.0 111.315 167.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.512 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 0.6 OUTLIER -80.38 -44.34 19.56 Favored 'General case' 0 N--CA 1.421 -1.914 0 N-CA-C 115.877 1.806 . . . . 0.0 115.877 -165.64 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -62.09 -22.64 65.96 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 118.779 -0.629 . . . . 0.0 110.393 170.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 59.2 tttp -76.35 -46.25 28.37 Favored 'General case' 0 C--N 1.349 0.566 0 CA-C-N 119.233 0.924 . . . . 0.0 109.694 166.026 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -52.22 -39.71 60.62 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.171 0.988 . . . . 0.0 110.982 177.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -61.04 -37.82 83.98 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 126.098 1.759 . . . . 0.0 111.225 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -61.36 -47.63 85.0 Favored 'General case' 0 C--O 1.226 -0.175 0 CA-C-O 118.413 -0.803 . . . . 0.0 109.5 170.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -56.68 -38.2 71.91 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 119.194 0.907 . . . . 0.0 110.943 179.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.505 ' ND2' HH12 ' A' ' 63' ' ' ARG . 2.2 m-80 -69.43 -31.1 69.23 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.918 0.887 . . . . 0.0 112.21 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 73.6 mt -76.09 -41.63 49.81 Favored 'General case' 0 C--O 1.225 -0.207 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 175.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -54.73 -38.88 67.66 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.425 1.49 . . . . 0.0 111.184 169.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.505 HH12 ' ND2' ' A' ' 60' ' ' ASN . 77.0 mtm-85 -66.63 -59.39 3.64 Favored 'General case' 0 C--N 1.345 0.41 0 CA-C-N 119.403 1.001 . . . . 0.0 109.753 169.085 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -73.1 65.74 0.8 Allowed 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 126.8 2.04 . . . . 0.0 110.918 -177.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.3 m -174.17 -164.15 0.18 Allowed 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 129.513 3.125 . . . . 0.0 105.132 -178.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -64.51 91.3 0.08 Allowed 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 167.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.4 m -65.21 41.0 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 128.976 2.91 . . . . 0.0 116.208 -168.281 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 10.8 mptt . . . . . 0 N--CA 1.465 0.316 0 C-N-CA 126.701 2.001 . . . . 0.0 110.313 175.113 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 91.2 mtp . . . . . 0 CA--C 1.538 0.486 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.83 159.94 50.57 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.425 2.083 . . . . 0.0 110.858 170.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -61.13 -26.52 67.74 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.012 1.725 . . . . 0.0 112.902 -171.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -147.38 177.15 9.46 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 127.753 2.421 . . . . 0.0 106.608 171.089 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.2 t0 -136.4 93.86 14.2 Favored Pre-proline 0 N--CA 1.448 -0.566 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 172.057 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -55.45 -33.53 86.26 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 124.204 3.269 . . . . 0.0 112.821 -175.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 63.1 m -94.61 -10.41 32.04 Favored 'General case' 0 N--CA 1.438 -1.068 0 C-N-CA 125.599 1.56 . . . . 0.0 113.19 -169.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 26.5 tp60 -62.6 -24.94 67.83 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 118.806 0.73 . . . . 0.0 111.161 -179.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -60.1 -54.38 46.58 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.434 1.094 . . . . 0.0 109.988 168.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -63.64 -38.83 92.62 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.655 0.782 . . . . 0.0 110.242 -177.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.14 -43.46 70.55 Favored 'General case' 0 C--N 1.341 0.197 0 C-N-CA 124.98 1.312 . . . . 0.0 112.645 169.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 77.8 m -57.56 -44.71 85.48 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 121.228 -0.189 . . . . 0.0 110.731 173.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -62.01 -25.81 67.87 Favored 'General case' 0 C--O 1.226 -0.137 0 CA-C-O 117.779 -1.105 . . . . 0.0 112.14 178.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 22.9 mm -59.38 -54.18 37.94 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.288 0 CA-C-N 120.251 1.387 . . . . 0.0 109.393 173.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -59.47 -53.45 58.05 Favored 'General case' 0 N--CA 1.445 -0.708 0 O-C-N 123.991 0.807 . . . . 0.0 109.014 -178.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.47 -31.99 72.52 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 118.987 -1.085 . . . . 0.0 111.664 -175.585 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.0 t -55.82 -48.03 76.16 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 119.42 1.009 . . . . 0.0 108.728 168.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.14 -47.24 83.93 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 123.279 0.632 . . . . 0.0 110.277 179.123 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -56.92 -46.25 82.12 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.45 0.7 . . . . 0.0 111.3 174.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.4 -13.97 59.86 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.017 0.927 . . . . 0.0 113.301 175.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.4 m-80 -124.13 10.32 8.73 Favored 'General case' 0 C--N 1.342 0.278 0 C-N-CA 124.458 1.103 . . . . 0.0 112.121 -173.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 14.8 m 58.22 39.99 25.24 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 119.825 1.193 . . . . 0.0 111.129 178.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.275 6.9 m-85 73.27 14.76 4.47 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 127.902 2.481 . . . . 0.0 114.774 168.635 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 50.6 mtm -66.57 85.15 0.11 Allowed 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 125.677 1.591 . . . . 0.0 110.251 169.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -56.95 -18.18 12.48 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.609 1.164 . . . . 0.0 112.157 170.124 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.4 p -61.5 -58.27 8.83 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 127.138 2.175 . . . . 0.0 110.797 167.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.5 mmtp -54.43 -41.0 68.88 Favored 'General case' 0 C--N 1.339 0.121 0 C-N-CA 123.392 0.677 . . . . 0.0 109.415 173.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.3 m -80.65 7.12 10.84 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -176.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 79.6 mm-40 -59.35 -27.42 65.92 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.833 1.197 . . . . 0.0 110.841 167.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.22 -54.3 48.41 Favored 'General case' 0 C--N 1.345 0.379 0 C-N-CA 125.513 1.525 . . . . 0.0 111.63 173.089 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.2 p -76.58 -28.74 17.88 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.811 0 C-N-CA 123.69 0.796 . . . . 0.0 109.838 -175.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 22.4 mt -59.74 -46.41 93.53 Favored 'Isoleucine or valine' 0 C--N 1.344 0.335 0 N-CA-C 107.034 -1.469 . . . . 0.0 107.034 167.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.34 -30.33 51.1 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 123.166 0.586 . . . . 0.0 112.358 173.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -78.18 -39.73 39.88 Favored 'General case' 0 N--CA 1.429 -1.518 0 C-N-CA 120.232 -0.587 . . . . 0.0 111.633 177.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.414 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.9 mt -63.65 -33.02 74.7 Favored 'General case' 0 C--N 1.343 0.315 0 CA-C-N 119.559 1.072 . . . . 0.0 110.362 172.272 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.12 -61.92 2.2 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.942 1.297 . . . . 0.0 109.406 175.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.9 ptmt -65.92 -29.76 70.23 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 114.51 -1.223 . . . . 0.0 110.888 -174.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 52.1 t -62.56 -51.21 68.27 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 168.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.6 t -60.54 -46.75 89.03 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.324 0.65 . . . . 0.0 111.309 -173.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.73 -1.94 4.42 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 125.097 1.359 . . . . 0.0 113.247 -179.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.55 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 21.0 tt0 -80.18 -10.87 59.78 Favored 'General case' 0 N--CA 1.44 -0.969 0 C-N-CA 123.969 0.907 . . . . 0.0 110.591 172.293 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.55 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 68.3 m-85 -139.37 161.06 59.25 Favored Pre-proline 0 N--CA 1.447 -0.613 0 C-N-CA 124.556 1.143 . . . . 0.0 112.476 -168.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -68.21 123.49 10.65 Favored 'Trans proline' 0 N--CA 1.457 -0.675 0 N-CA-C 104.814 -2.802 . . . . 0.0 104.814 164.095 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.0 ptmt -48.97 -33.63 11.37 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 116.5 2.037 . . . . 0.0 116.5 -166.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.85 -15.05 40.28 Favored Glycine 0 CA--C 1.532 1.134 0 CA-C-N 118.899 0.772 . . . . 0.0 113.806 178.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.8 tpm_? -64.58 -12.95 50.44 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 125.223 1.409 . . . . 0.0 112.457 171.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.9 t -149.93 141.09 23.07 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 122.478 1.132 . . . . 0.0 111.756 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.5 t -71.8 -54.12 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 CA-C-N 114.571 -1.195 . . . . 0.0 108.913 178.116 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 6.8 m -59.52 -39.46 79.38 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 122.63 0.372 . . . . 0.0 110.085 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . 0.493 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 12.2 t -67.54 -37.23 82.4 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.686 1.195 . . . . 0.0 110.176 177.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 54.1 m -63.7 -27.83 69.48 Favored 'General case' 0 N--CA 1.453 -0.32 0 O-C-N 121.883 -0.511 . . . . 0.0 110.87 172.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.29 -25.47 72.96 Favored Glycine 0 C--N 1.343 0.958 0 CA-C-O 122.025 0.791 . . . . 0.0 112.195 170.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.493 ' HB2' ' HA ' ' A' ' 50' ' ' CYS . 0.2 OUTLIER -82.35 -49.45 10.01 Favored 'General case' 0 N--CA 1.433 -1.309 0 C-N-CA 126.087 1.755 . . . . 0.0 115.12 -167.72 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -66.23 -20.97 66.27 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.105 172.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -72.05 -40.7 68.16 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 118.514 0.597 . . . . 0.0 109.967 166.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -55.53 -45.94 77.12 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 119.457 1.026 . . . . 0.0 109.825 169.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 30.1 tp10 -63.67 -34.29 77.52 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.821 0.848 . . . . 0.0 111.391 178.443 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -60.89 -31.91 71.37 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 118.731 0.696 . . . . 0.0 111.514 172.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -67.64 -53.26 29.36 Favored 'General case' 0 C--N 1.341 0.198 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 168.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -64.78 -34.89 79.41 Favored 'General case' 0 C--O 1.231 0.115 0 C-N-CA 123.797 0.839 . . . . 0.0 112.385 -168.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 4.2 pp -61.73 -19.32 62.28 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 118.799 0.727 . . . . 0.0 112.639 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 40.5 p -65.68 -53.63 38.51 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-N 118.798 0.726 . . . . 0.0 109.421 170.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -36.77 84.71 Favored 'General case' 0 C--N 1.339 0.116 0 C-N-CA 124.396 1.078 . . . . 0.0 111.037 178.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -69.36 17.94 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 177.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 66.3 m -69.04 169.75 11.23 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 125.441 1.496 . . . . 0.0 109.869 168.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.74 139.52 53.68 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 121.161 0.505 . . . . 0.0 110.19 171.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 41.8 m -168.1 172.27 8.88 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 126.615 1.966 . . . . 0.0 107.49 175.2 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 63.4 tttp . . . . . 0 CA--C 1.531 0.219 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 174.091 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.6 mtt . . . . . 0 CA--C 1.539 0.536 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -78.49 64.46 8.55 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 123.738 2.959 . . . . 0.0 110.801 176.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -68.52 24.58 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 127.013 2.125 . . . . 0.0 113.731 -176.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt 47.59 -127.74 1.73 Allowed 'General case' 0 C--N 1.344 0.34 0 C-N-CA 125.088 1.355 . . . . 0.0 108.617 -169.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -91.28 97.5 1.36 Allowed Pre-proline 0 C--N 1.32 -0.693 0 N-CA-C 106.369 -1.715 . . . . 0.0 106.369 168.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -56.01 -37.04 96.75 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 123.536 2.824 . . . . 0.0 112.362 -169.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 67.5 m -92.92 -8.86 42.03 Favored 'General case' 0 N--CA 1.438 -1.053 0 C-N-CA 125.707 1.603 . . . . 0.0 113.396 -168.699 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 28.8 tp60 -62.27 -25.05 67.63 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 118.321 0.509 . . . . 0.0 110.51 178.328 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.3 tmtm? -58.27 -56.93 15.69 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.387 1.075 . . . . 0.0 109.446 168.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 21.1 mp0 -61.96 -39.13 91.07 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.037 0.935 . . . . 0.0 110.749 -177.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -55.27 -44.83 76.0 Favored 'General case' 0 C--N 1.338 0.108 0 C-N-CA 124.319 1.048 . . . . 0.0 112.203 170.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.4 m -59.02 -41.65 88.28 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 121.06 -0.256 . . . . 0.0 111.078 172.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -64.26 -21.96 66.78 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-O 117.432 -1.27 . . . . 0.0 112.941 176.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.421 HD13 HG13 ' A' ' 31' ' ' VAL . 44.3 mm -59.64 -51.1 76.74 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-N 121.029 1.74 . . . . 0.0 109.34 172.593 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 8.4 mm-40 -61.14 -55.89 27.19 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 108.274 -1.009 . . . . 0.0 108.274 178.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 17.7 mtpp -66.2 -27.84 68.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 118.405 -0.807 . . . . 0.0 111.481 -172.082 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.404 ' CB ' HG11 ' A' ' 31' ' ' VAL . 15.7 t -56.71 -51.36 69.1 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 119.14 0.882 . . . . 0.0 109.034 168.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.416 HD12 ' SG ' ' A' ' 28' ' ' CYS . 0.2 OUTLIER -56.05 -46.71 78.83 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 123.524 0.729 . . . . 0.0 110.723 178.061 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.458 ' HA ' ' CE1' ' A' ' 23' ' ' TYR . 1.5 mp0 -56.86 -44.49 82.23 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 122.908 0.483 . . . . 0.0 111.635 174.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.18 -14.38 61.79 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 177.061 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -120.89 14.19 11.55 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.362 1.065 . . . . 0.0 113.248 -168.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 17.2 m 60.98 35.98 18.81 Favored 'General case' 0 C--N 1.346 0.442 0 CA-C-N 120.55 1.523 . . . . 0.0 110.035 -178.244 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.458 ' CE1' ' HA ' ' A' ' 19' ' ' GLN . 45.4 m-85 66.63 16.68 10.46 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 126.516 1.926 . . . . 0.0 113.597 168.555 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 58.0 mtm -72.27 88.04 1.14 Allowed 'General case' 0 N--CA 1.438 -1.039 0 C-N-CA 126.36 1.864 . . . . 0.0 108.808 173.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -52.85 -27.97 20.78 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.016 0.927 . . . . 0.0 110.532 170.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.0 m -57.22 -35.94 70.28 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 127.184 2.194 . . . . 0.0 113.325 171.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.5 mmtm -72.82 -43.5 62.6 Favored 'General case' 0 C--O 1.233 0.214 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 170.595 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.416 ' SG ' HD12 ' A' ' 18' ' ' LEU 0.25 74.7 m -73.42 1.42 9.77 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 123.875 0.87 . . . . 0.0 113.116 -170.495 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.418 ' HA ' HD12 ' A' ' 32' ' ' ILE . 61.6 mm-40 -55.56 -31.87 62.53 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.319 -0.863 . . . . 0.0 109.919 165.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.97 -53.48 57.78 Favored 'General case' 0 C--N 1.346 0.423 0 C-N-CA 124.531 1.132 . . . . 0.0 111.684 173.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.421 HG13 HD13 ' A' ' 14' ' ' ILE . 7.5 p -75.97 -24.47 16.6 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 C-N-CA 122.863 0.465 . . . . 0.0 110.245 -174.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.506 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 40.3 mt -62.53 -49.38 84.05 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 N-CA-C 106.561 -1.644 . . . . 0.0 106.561 167.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -55.92 -29.9 60.8 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 118.94 0.791 . . . . 0.0 111.142 174.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -71.42 -44.19 65.34 Favored 'General case' 0 N--CA 1.446 -0.628 0 O-C-N 121.313 -0.867 . . . . 0.0 112.288 175.16 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.495 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.3 mt -59.77 -33.44 71.7 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-N 119.038 0.835 . . . . 0.0 109.777 172.132 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.406 ' HE ' ' HA ' ' A' ' 57' ' ' GLU . 4.6 ttt-85 -62.21 -57.01 13.04 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 126.052 1.741 . . . . 0.0 110.629 178.096 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -62.9 -35.64 80.71 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 124.486 1.114 . . . . 0.0 110.872 -179.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.3 t -62.38 -50.27 72.24 Favored 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 169.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 52.6 t -63.94 -48.93 74.59 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 123.2 0.6 . . . . 0.0 111.724 -170.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.4 -0.65 5.14 Favored 'General case' 0 N--CA 1.444 -0.737 0 C-N-CA 124.575 1.15 . . . . 0.0 112.091 -177.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.471 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 2.1 tp-100 -80.06 -7.49 58.89 Favored 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 123.797 0.839 . . . . 0.0 110.963 173.475 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.471 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 73.3 m-85 -143.28 161.36 48.1 Favored Pre-proline 0 N--CA 1.444 -0.749 0 C-N-CA 124.286 1.035 . . . . 0.0 112.472 -168.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -69.24 110.15 2.38 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 N-CA-C 105.284 -2.622 . . . . 0.0 105.284 164.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -43.52 -30.49 0.58 Allowed 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 117.937 2.569 . . . . 0.0 117.937 -166.584 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -55.39 -16.44 9.98 Favored Glycine 0 CA--C 1.538 1.5 0 CA-C-N 119.559 1.072 . . . . 0.0 114.071 172.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 12.7 tpt180 -54.12 -28.22 38.22 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 127.062 2.145 . . . . 0.0 111.789 168.432 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.2 t -146.63 140.89 26.35 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-O 122.483 1.135 . . . . 0.0 112.36 -169.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 11.7 t -69.26 -55.66 14.54 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-N 114.107 -1.406 . . . . 0.0 108.941 178.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 7.6 m -59.21 -41.72 84.73 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 122.897 0.479 . . . . 0.0 109.915 -177.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . 0.49 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 14.0 t -67.33 -35.55 79.64 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.967 1.307 . . . . 0.0 110.044 179.211 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 54.7 m -65.95 -23.63 66.64 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 118.734 -0.651 . . . . 0.0 111.156 172.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -77.12 -26.91 61.0 Favored Glycine 0 C--N 1.345 1.04 0 CA-C-O 122.423 1.013 . . . . 0.0 111.832 168.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.506 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 0.4 OUTLIER -80.15 -41.54 25.18 Favored 'General case' 0 N--CA 1.42 -1.958 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 -166.8 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -62.27 -20.49 64.33 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 123.883 0.739 . . . . 0.0 111.164 177.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.419 ' HA ' ' HE2' ' A' ' 55' ' ' LYS . 0.2 OUTLIER -67.29 -54.96 16.08 Favored 'General case' 0 C--N 1.348 0.531 0 CA-C-N 118.823 0.738 . . . . 0.0 109.647 167.511 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.9 tp10 -56.42 -41.67 76.75 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.57 1.148 . . . . 0.0 111.15 178.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.406 ' HA ' ' HE ' ' A' ' 36' ' ' ARG . 44.2 tt0 -57.75 -42.29 83.66 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 127.808 2.443 . . . . 0.0 110.727 -179.304 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -67.2 -33.6 75.72 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.972 1.309 . . . . 0.0 111.471 177.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 47.3 mm-40 -66.49 -48.91 68.32 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 121.814 0.816 . . . . 0.0 109.66 169.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -70.51 -33.72 71.51 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 117.089 -1.434 . . . . 0.0 113.256 -168.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 4.0 pp -59.47 -12.78 6.8 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 119.615 1.098 . . . . 0.0 113.462 -175.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 35.5 p -55.7 -60.5 3.36 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.436 1.495 . . . . 0.0 108.787 167.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 45.3 ttp180 -71.6 -63.96 1.02 Allowed 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 127.771 2.428 . . . . 0.0 110.081 172.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -80.61 45.06 0.76 Allowed 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 128.988 2.915 . . . . 0.0 111.335 -171.291 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -76.27 179.91 5.48 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 126.069 1.748 . . . . 0.0 110.155 168.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.07 -178.94 0.5 Allowed 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.185 0.994 . . . . 0.0 110.788 168.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 6.9 m -65.62 66.96 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 127.068 2.147 . . . . 0.0 113.771 -176.229 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 47.0 mtmt . . . . . 0 N--CA 1.464 0.233 0 C-N-CA 126.436 1.894 . . . . 0.0 110.245 176.888 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.52 ' N ' HH12 ' A' ' 46' ' ' ARG . 26.1 mmt . . . . . 0 CA--C 1.538 0.509 0 CA-C-O 118.861 -0.59 . . . . 0.0 109.592 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -75.9 70.5 5.88 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 123.365 2.71 . . . . 0.0 109.558 169.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -141.91 165.12 28.33 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 127.339 2.256 . . . . 0.0 109.418 -178.567 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -65.77 -178.93 0.62 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.558 1.143 . . . . 0.0 112.523 -178.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.2 t0 -93.01 97.65 1.9 Allowed Pre-proline 0 CA--C 1.539 0.533 0 N-CA-C 106.148 -1.797 . . . . 0.0 106.148 168.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo -62.04 -30.67 83.24 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 124.318 3.345 . . . . 0.0 112.685 -172.131 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 89.9 m -93.29 -14.17 27.3 Favored 'General case' 0 N--CA 1.437 -1.076 0 C-N-CA 124.863 1.265 . . . . 0.0 112.299 -168.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 21.4 tp60 -60.48 -25.53 66.12 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 123.432 0.693 . . . . 0.0 110.739 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 65.9 tttp -62.08 -56.85 14.71 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 124.14 0.976 . . . . 0.0 110.162 168.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -61.15 -37.7 83.79 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.788 0.835 . . . . 0.0 110.481 -176.355 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.49 -43.64 71.96 Favored 'General case' 0 CA--C 1.52 -0.195 0 C-N-CA 125.186 1.394 . . . . 0.0 112.826 169.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.8 m -58.75 -43.86 90.39 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 121.028 0.442 . . . . 0.0 110.817 173.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 40.2 mm-40 -64.27 -21.1 66.47 Favored 'General case' 0 N--CA 1.456 -0.151 0 CA-C-O 117.735 -1.126 . . . . 0.0 112.387 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.402 HD13 HG13 ' A' ' 31' ' ' VAL . 36.8 mm -60.12 -52.62 59.1 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 CA-C-N 120.574 1.534 . . . . 0.0 109.363 171.753 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -58.27 -55.52 33.96 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 107.624 -1.251 . . . . 0.0 107.624 -179.231 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 41.1 mtpt -70.02 -29.44 66.5 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 118.201 -0.904 . . . . 0.0 111.64 -170.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.411 ' CB ' HG11 ' A' ' 31' ' ' VAL . 16.8 t -56.87 -47.05 81.36 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 168.57 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.15 -45.45 90.93 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 118.377 -0.82 . . . . 0.0 110.133 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -58.47 -46.53 86.42 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 119.428 1.013 . . . . 0.0 111.222 174.228 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.05 -14.57 55.41 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.811 0.844 . . . . 0.0 113.24 176.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -122.56 9.16 9.58 Favored 'General case' 0 C--N 1.342 0.256 0 C-N-CA 124.228 1.011 . . . . 0.0 112.231 -173.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.6 m 58.25 40.23 24.91 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 122.601 1.191 . . . . 0.0 110.776 179.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.26 7.1 m-85 72.14 15.1 5.53 Favored 'General case' 0 N--CA 1.443 -0.812 0 C-N-CA 127.914 2.485 . . . . 0.0 114.316 169.075 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 67.3 mtm -70.44 86.82 0.62 Allowed 'General case' 0 N--CA 1.441 -0.915 0 C-N-CA 125.5 1.52 . . . . 0.0 110.047 169.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -55.05 -23.47 20.19 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 125.769 1.628 . . . . 0.0 110.569 168.183 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -55.26 -41.53 72.31 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.864 1.665 . . . . 0.0 112.004 169.576 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 50.6 mmtt -73.7 -45.68 50.83 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.991 0.916 . . . . 0.0 108.555 175.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.1 m -73.68 1.6 9.92 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -172.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.471 HE22 ' NH1' ' A' ' 63' ' ' ARG . 65.4 mm-40 -51.81 -34.57 40.72 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 119.105 0.866 . . . . 0.0 109.986 166.509 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.68 -57.4 12.9 Favored 'General case' 0 C--N 1.346 0.425 0 C-N-CA 125.757 1.623 . . . . 0.0 111.447 175.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.411 HG11 ' CB ' ' A' ' 17' ' ' CYS . 8.7 p -72.44 -29.79 32.45 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.645 0 C-N-CA 123.618 0.767 . . . . 0.0 110.194 -173.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.44 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 56.2 mt -59.97 -50.66 79.27 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 N-CA-C 106.129 -1.804 . . . . 0.0 106.129 168.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.417 HE22 ' NH1' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -56.91 -28.84 62.47 Favored 'General case' 0 N--CA 1.448 -0.574 0 O-C-N 121.635 -0.666 . . . . 0.0 112.77 175.306 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -74.99 -37.94 61.74 Favored 'General case' 0 N--CA 1.432 -1.361 0 CA-C-N 118.585 0.63 . . . . 0.0 111.39 177.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.416 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.4 mt -59.27 -34.11 71.86 Favored 'General case' 0 C--N 1.346 0.418 0 CA-C-N 119.502 1.046 . . . . 0.0 109.872 169.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.417 ' NH1' HE22 ' A' ' 33' ' ' GLN . 0.8 OUTLIER -67.13 -55.62 13.43 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.214 1.406 . . . . 0.0 111.732 179.722 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 57.4 mttm -62.09 -33.31 74.19 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 124.822 1.249 . . . . 0.0 110.326 178.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.3 t -64.2 -52.76 57.29 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 168.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.4 t -57.7 -50.31 73.63 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 123.762 0.825 . . . . 0.0 112.079 -172.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.79 -0.87 7.84 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 114.961 -1.018 . . . . 0.0 112.444 -175.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.468 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 2.7 tp-100 -85.38 -6.57 59.21 Favored 'General case' 0 N--CA 1.437 -1.111 0 C-N-CA 124.345 1.058 . . . . 0.0 111.548 179.408 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.468 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 77.9 m-85 -140.26 160.23 60.68 Favored Pre-proline 0 N--CA 1.445 -0.685 0 C-N-CA 124.472 1.109 . . . . 0.0 111.609 -168.7 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -67.37 118.17 5.38 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 N-CA-C 106.408 -2.189 . . . . 0.0 106.408 166.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 62.1 tttm -41.27 -38.15 1.1 Allowed 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 117.024 2.231 . . . . 0.0 117.024 -168.019 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.28 -13.62 16.28 Favored Glycine 0 CA--C 1.537 1.418 0 C-N-CA 123.997 0.808 . . . . 0.0 114.066 176.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.52 HH12 ' N ' ' A' ' 1' ' ' MET . 0.1 OUTLIER -56.77 -31.12 64.3 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 126.381 1.872 . . . . 0.0 112.057 169.495 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.5 t -146.01 136.97 24.5 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-O 123.113 1.435 . . . . 0.0 113.798 -168.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.1 t -71.89 -54.57 16.37 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.735 0 CA-C-N 112.726 -2.034 . . . . 0.0 108.833 177.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 17.7 m -60.19 -39.36 80.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 C-N-CA 123.004 0.522 . . . . 0.0 110.558 -178.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . 0.448 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 6.3 t -66.54 -38.9 88.13 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.102 1.361 . . . . 0.0 109.954 176.328 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 51.2 m -64.88 -26.64 68.41 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-O 119.231 -0.414 . . . . 0.0 110.822 172.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.34 -26.47 71.92 Favored Glycine 0 C--N 1.342 0.915 0 CA-C-N 118.088 0.404 . . . . 0.0 112.291 169.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.448 ' HB2' ' HA ' ' A' ' 50' ' ' CYS . 0.3 OUTLIER -81.2 -48.11 12.52 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 115.893 1.812 . . . . 0.0 115.893 -165.737 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -64.5 -19.14 65.4 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.243 173.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -80.27 -42.93 22.23 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.068 0.849 . . . . 0.0 109.928 166.005 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -56.22 -33.9 65.79 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.663 1.185 . . . . 0.0 110.865 176.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.7 tm-20 -58.75 -36.2 73.97 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.524 1.13 . . . . 0.0 110.47 176.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -73.45 -41.07 63.66 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.224 0.61 . . . . 0.0 109.701 174.172 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -57.54 -34.5 69.21 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.557 0.743 . . . . 0.0 112.057 174.355 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.482 ' ND2' ' HE ' ' A' ' 63' ' ' ARG . 1.3 m-80 -60.82 -29.69 69.64 Favored 'General case' 0 C--N 1.332 -0.158 0 C-N-CA 123.664 0.786 . . . . 0.0 112.284 -178.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 54.5 mt -58.77 -30.57 67.65 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.767 0.827 . . . . 0.0 111.051 172.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 20.5 p -81.54 -47.76 12.67 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 124.818 1.247 . . . . 0.0 110.779 173.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.482 ' HE ' ' ND2' ' A' ' 60' ' ' ASN . 23.3 mtm105 -54.78 -57.47 11.42 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 123.601 0.76 . . . . 0.0 110.47 -178.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 40.32 -130.98 0.34 Allowed 'General case' 0 C--O 1.237 0.401 0 C-N-CA 125.696 1.599 . . . . 0.0 110.611 176.095 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 11.0 m -62.24 -20.63 64.43 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 126.495 1.918 . . . . 0.0 115.535 -176.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -83.48 19.83 1.49 Allowed 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 127.855 2.462 . . . . 0.0 113.298 175.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 74.6 m -66.58 76.04 0.11 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 126.244 1.818 . . . . 0.0 109.184 169.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.466 0.35 0 C-N-CA 127.188 2.195 . . . . 0.0 111.588 -170.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 CA--C 1.542 0.666 0 CA-C-O 119.816 -0.135 . . . . 0.0 111.071 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -80.52 48.6 2.94 Favored 'Trans proline' 0 CA--C 1.545 1.033 0 C-N-CA 123.389 2.726 . . . . 0.0 112.362 -172.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -57.39 91.45 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 126.648 1.979 . . . . 0.0 112.35 -169.039 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.7 mptp? 46.76 19.57 0.09 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 129.172 2.989 . . . . 0.0 113.387 -169.318 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -145.97 98.67 4.39 Favored Pre-proline 0 N--CA 1.442 -0.827 0 C-N-CA 128.318 2.647 . . . . 0.0 105.964 -168.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -53.56 -31.51 59.59 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 124.363 3.375 . . . . 0.0 112.868 -169.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.409 ' HB3' ' CD2' ' A' ' 35' ' ' LEU . 73.0 m -94.26 -13.69 26.27 Favored 'General case' 0 N--CA 1.428 -1.553 0 C-N-CA 126.384 1.874 . . . . 0.0 112.735 -170.414 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 32.3 tp60 -63.11 -25.58 68.43 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 118.898 0.772 . . . . 0.0 110.767 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -60.37 -53.62 55.45 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.979 0.912 . . . . 0.0 110.191 169.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -64.86 -38.97 92.74 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.249 0.62 . . . . 0.0 110.155 -178.162 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.07 -45.33 71.7 Favored 'General case' 0 C--N 1.341 0.216 0 C-N-CA 125.186 1.394 . . . . 0.0 112.061 169.537 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 89.1 m -57.33 -43.05 83.05 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 117.632 0.196 . . . . 0.0 110.473 173.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -65.06 -25.29 67.75 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-O 117.547 -1.216 . . . . 0.0 113.053 176.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 30.2 mm -58.71 -52.01 65.1 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 CA-C-N 120.677 1.581 . . . . 0.0 108.961 171.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -60.8 -53.5 56.65 Favored 'General case' 0 N--CA 1.442 -0.862 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 -175.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 16.2 mtpp -69.28 -31.1 69.38 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 118.215 -0.898 . . . . 0.0 111.849 -174.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.9 t -56.87 -45.9 82.18 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 169.026 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.6 -45.26 92.44 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-O 118.481 -0.771 . . . . 0.0 110.467 179.162 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -58.43 -44.81 89.26 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 119.219 0.918 . . . . 0.0 111.314 173.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.24 -13.46 58.38 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 113.345 0.869 . . . . 0.0 113.345 175.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 -124.82 9.35 8.22 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 124.483 1.113 . . . . 0.0 112.405 -172.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.3 m 58.04 40.12 25.69 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 122.318 1.056 . . . . 0.0 110.862 179.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.258 6.7 m-85 72.23 13.35 5.71 Favored 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 127.854 2.462 . . . . 0.0 114.661 168.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 67.3 mtm -70.78 85.87 0.67 Allowed 'General case' 0 N--CA 1.442 -0.851 0 C-N-CA 125.039 1.336 . . . . 0.0 109.798 170.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -53.58 -25.85 19.08 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.178 0.591 . . . . 0.0 111.45 171.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.1 m -51.09 -42.02 60.36 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 126.13 1.772 . . . . 0.0 112.317 170.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 55.1 mmtt -70.89 -47.59 58.34 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 124.188 0.995 . . . . 0.0 108.93 174.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.2 m -72.7 2.71 6.07 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 124.662 1.185 . . . . 0.0 113.171 -174.408 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 52.4 mm-40 -56.23 -28.25 57.78 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 119.814 1.188 . . . . 0.0 109.874 166.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.97 -56.24 24.33 Favored 'General case' 0 C--N 1.346 0.44 0 C-N-CA 125.313 1.445 . . . . 0.0 111.833 172.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.1 p -75.74 -26.02 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.746 0 C-N-CA 123.625 0.77 . . . . 0.0 109.826 -174.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.544 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 57.6 mt -62.75 -44.3 99.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 N-CA-C 107.309 -1.367 . . . . 0.0 107.309 168.517 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.466 HE22 ' NH1' ' A' ' 36' ' ' ARG . 2.9 tp-100 -56.47 -28.33 59.4 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 123.506 0.723 . . . . 0.0 112.379 172.401 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -74.98 -44.02 50.69 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 118.571 0.623 . . . . 0.0 111.854 173.011 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.512 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.6 mt -63.64 -30.89 71.94 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 119.294 0.952 . . . . 0.0 110.901 175.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.466 ' NH1' HE22 ' A' ' 33' ' ' GLN . 0.2 OUTLIER -57.26 -59.29 5.34 Favored 'General case' 0 CA--C 1.519 -0.233 0 C-N-CA 124.443 1.097 . . . . 0.0 109.415 173.502 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 48.8 mttp -60.04 -37.7 80.57 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 113.751 -1.568 . . . . 0.0 110.972 -177.295 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 42.5 t -62.2 -52.18 64.84 Favored 'General case' 0 N--CA 1.442 -0.861 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 171.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.5 t -61.6 -45.26 94.84 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.532 0.733 . . . . 0.0 111.888 -171.343 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.75 -2.4 11.85 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.095 -0.957 . . . . 0.0 112.883 -177.343 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.469 ' HB3' ' CE1' ' A' ' 42' ' ' TYR . 2.6 tp-100 -86.3 -5.53 59.16 Favored 'General case' 0 N--CA 1.438 -1.027 0 C-N-CA 124.651 1.18 . . . . 0.0 111.565 -178.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.469 ' CE1' ' HB3' ' A' ' 41' ' ' GLN . 82.7 m-85 -139.38 160.89 60.03 Favored Pre-proline 0 N--CA 1.445 -0.715 0 C-N-CA 125.13 1.372 . . . . 0.0 110.708 -168.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -67.42 111.12 2.22 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 N-CA-C 104.574 -2.895 . . . . 0.0 104.574 165.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 36.4 mmtm -39.43 -40.54 0.84 Allowed 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 116.753 2.131 . . . . 0.0 116.753 -165.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.5 -11.81 11.28 Favored Glycine 0 CA--C 1.536 1.398 0 C-N-CA 124.679 1.133 . . . . 0.0 114.303 176.259 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 31.9 tpt85 -52.52 -33.83 47.06 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 127.072 2.149 . . . . 0.0 111.675 169.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.0 t -140.71 140.75 34.94 Favored 'General case' 0 N--CA 1.44 -0.966 0 CA-C-O 122.424 1.107 . . . . 0.0 111.703 -167.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 8.8 t -70.34 -54.27 19.26 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 CA-C-N 113.828 -1.533 . . . . 0.0 108.781 179.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 7.0 m -61.48 -38.05 79.19 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-O 119.211 -0.423 . . . . 0.0 110.376 -178.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . 0.467 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 11.9 t -67.32 -37.73 83.79 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.378 1.071 . . . . 0.0 109.93 176.67 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 45.2 m -64.97 -27.04 68.57 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.817 -0.552 . . . . 0.0 110.649 172.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -71.36 -26.84 72.61 Favored Glycine 0 C--N 1.344 0.993 0 CA-C-O 121.74 0.633 . . . . 0.0 112.136 169.485 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.544 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 0.2 OUTLIER -82.04 -48.18 11.73 Favored 'General case' 0 N--CA 1.432 -1.34 0 C-N-CA 126.059 1.744 . . . . 0.0 115.074 -167.153 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -64.65 -16.04 62.19 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-O 118.732 -0.651 . . . . 0.0 110.794 172.292 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.85 -46.57 16.62 Favored 'General case' 0 C--N 1.347 0.461 0 C-N-CA 123.905 0.882 . . . . 0.0 109.064 165.29 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.2 tp10 -53.32 -34.51 57.73 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.993 0.917 . . . . 0.0 111.061 175.105 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -60.25 -36.54 77.99 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.931 1.692 . . . . 0.0 111.542 175.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -67.69 -31.03 70.72 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.71 0.804 . . . . 0.0 110.881 176.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -70.31 -48.51 56.31 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 169.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -65.49 -32.93 74.8 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 124.056 0.943 . . . . 0.0 112.401 -169.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 4.1 pp -64.55 -9.88 22.16 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 175.022 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 27.0 p -83.9 -52.25 6.51 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 123.849 0.86 . . . . 0.0 109.115 168.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 9.3 mtp180 -58.7 -66.07 0.56 Allowed 'General case' 0 C--N 1.343 0.326 0 C-N-CA 126.982 2.113 . . . . 0.0 110.408 -179.184 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 26.0 mtmt -82.46 73.47 9.5 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 105.34 -2.096 . . . . 0.0 105.34 168.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.5 m -55.4 141.38 36.52 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.225 1.01 . . . . 0.0 112.148 -168.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . 44.59 42.96 6.15 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.368 1.467 . . . . 0.0 112.113 -176.158 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 30.3 m -162.48 -171.45 2.78 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 126.823 2.049 . . . . 0.0 107.375 179.044 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 49.3 mtpt . . . . . 0 CA--C 1.535 0.396 0 O-C-N 121.22 -0.925 . . . . 0.0 109.564 178.855 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.2 mtm . . . . . 0 C--O 1.239 0.535 0 CA-C-O 118.391 -0.814 . . . . 0.0 109.131 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -77.44 60.68 7.15 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 C-N-CA 124.464 3.443 . . . . 0.0 111.232 -178.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -62.62 -36.99 84.54 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 126.243 1.817 . . . . 0.0 110.912 -176.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.0 mtpp -72.84 75.59 1.15 Allowed 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 168.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -97.82 103.58 17.63 Favored Pre-proline 0 CA--C 1.541 0.63 0 C-N-CA 127.306 2.243 . . . . 0.0 109.977 -169.134 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -55.15 -32.02 78.19 Favored 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 124.37 3.38 . . . . 0.0 113.418 -176.134 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 66.3 m -98.53 -10.98 22.7 Favored 'General case' 0 N--CA 1.437 -1.099 0 C-N-CA 125.929 1.692 . . . . 0.0 113.36 -168.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 20.2 tp60 -64.09 -25.91 68.31 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 118.614 0.643 . . . . 0.0 111.126 -179.104 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -59.34 -55.78 30.43 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.016 0.926 . . . . 0.0 109.54 169.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -63.92 -36.05 82.67 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.539 0.735 . . . . 0.0 110.126 -177.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -60.46 -39.16 86.57 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 124.047 0.939 . . . . 0.0 112.065 174.095 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 70.9 m -58.18 -44.76 88.19 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 118.494 0.588 . . . . 0.0 110.553 171.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 30.4 mm-40 -64.58 -22.68 67.04 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 117.745 -1.122 . . . . 0.0 112.393 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.424 HD13 HG13 ' A' ' 31' ' ' VAL . 43.8 mm -58.55 -55.14 24.65 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.263 0 CA-C-N 120.377 1.444 . . . . 0.0 109.302 171.161 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -60.31 -53.04 62.39 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 -177.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 16.0 mtpp -68.12 -30.74 69.97 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 118.264 -0.874 . . . . 0.0 111.495 -174.011 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.8 t -58.49 -47.77 83.01 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 119.412 1.005 . . . . 0.0 108.657 168.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.74 -46.96 83.75 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 123.235 0.614 . . . . 0.0 110.178 179.555 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -57.42 -44.67 84.82 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.777 0.831 . . . . 0.0 111.39 173.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.72 -13.21 61.06 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 174.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 45.2 m-80 -124.25 8.46 8.51 Favored 'General case' 0 C--N 1.343 0.284 0 C-N-CA 124.515 1.126 . . . . 0.0 112.304 -172.129 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.1 m 59.0 40.31 22.47 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 122.44 1.115 . . . . 0.0 110.807 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.272 7.1 m-85 72.11 14.48 5.66 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 127.697 2.399 . . . . 0.0 114.649 168.636 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 60.7 mtm -69.38 84.64 0.4 Allowed 'General case' 0 N--CA 1.441 -0.875 0 C-N-CA 125.403 1.481 . . . . 0.0 110.218 169.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 51.3 tt0 -54.0 -23.18 12.45 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.066 1.347 . . . . 0.0 111.955 169.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.7 m -58.61 -47.59 83.84 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 126.114 1.765 . . . . 0.0 111.699 169.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.4 mmtm -64.64 -47.95 76.63 Favored 'General case' 0 C--N 1.342 0.244 0 C-N-CA 124.095 0.958 . . . . 0.0 108.897 175.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 71.5 m -68.95 2.13 2.9 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 124.601 1.16 . . . . 0.0 113.186 -179.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -54.58 -27.62 40.25 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 119.826 1.194 . . . . 0.0 111.598 167.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.62 -54.66 43.94 Favored 'General case' 0 C--N 1.344 0.354 0 C-N-CA 124.747 1.219 . . . . 0.0 111.936 172.155 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.424 HG13 HD13 ' A' ' 14' ' ' ILE . 10.0 p -77.62 -30.58 16.93 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.738 0 C-N-CA 123.483 0.713 . . . . 0.0 110.192 -173.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.635 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 57.9 mt -63.54 -42.26 95.52 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 169.563 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.99 -40.47 66.96 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-N 119.981 1.264 . . . . 0.0 111.547 169.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -70.08 -39.82 75.36 Favored 'General case' 0 N--CA 1.435 -1.222 0 C-N-CA 118.975 -1.09 . . . . 0.0 110.345 -178.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.503 HD13 ' CD1' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -71.3 -27.68 63.58 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 123.654 0.782 . . . . 0.0 110.046 179.378 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.596 HH11 HG22 ' A' ' 32' ' ' ILE . 0.3 OUTLIER -62.25 -59.09 5.53 Favored 'General case' 0 CA--C 1.519 -0.227 0 C-N-CA 126.616 1.967 . . . . 0.0 107.714 172.053 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 58.0 mttm -59.04 -38.99 80.62 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 114.489 -1.232 . . . . 0.0 110.462 -178.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 43.7 t -59.25 -54.23 49.25 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 123.79 0.836 . . . . 0.0 108.955 172.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 47.3 t -60.42 -42.58 96.3 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 121.593 0.711 . . . . 0.0 111.922 -173.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.44 -3.35 11.04 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.787 1.235 . . . . 0.0 113.466 -179.358 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.563 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 20.7 tt0 -84.39 -9.48 58.38 Favored 'General case' 0 N--CA 1.44 -0.959 0 C-N-CA 124.381 1.073 . . . . 0.0 111.019 178.203 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.563 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 71.6 m-85 -140.37 160.98 57.53 Favored Pre-proline 0 N--CA 1.446 -0.671 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -166.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -69.66 125.83 12.66 Favored 'Trans proline' 0 N--CA 1.457 -0.633 0 N-CA-C 105.312 -2.611 . . . . 0.0 105.312 164.399 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 37.8 mmtt -52.91 -31.38 39.56 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 115.362 1.616 . . . . 0.0 115.362 -165.365 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.12 -13.16 26.45 Favored Glycine 0 CA--C 1.535 1.315 0 C-N-CA 124.014 0.816 . . . . 0.0 113.975 175.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.595 HH11 ' HG3' ' A' ' 46' ' ' ARG . 3.9 tpm_? -65.48 -15.38 62.59 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.481 1.912 . . . . 0.0 112.748 169.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.1 t -153.26 137.57 16.61 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 120.095 1.316 . . . . 0.0 112.612 -173.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 20.4 t -68.26 -55.65 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.658 0 CA-C-N 113.784 -1.553 . . . . 0.0 108.813 174.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 7.5 m -61.26 -43.65 96.91 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 CA-C-O 118.881 -0.581 . . . . 0.0 110.079 -174.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 11.1 t -63.87 -33.55 75.95 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.776 1.631 . . . . 0.0 110.01 178.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 61.5 m -67.1 -26.2 66.59 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 119.127 -0.463 . . . . 0.0 111.118 172.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.77 -33.4 57.89 Favored Glycine 0 C--N 1.345 1.042 0 CA-C-O 123.313 1.507 . . . . 0.0 111.055 167.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.635 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 0.7 OUTLIER -78.23 -41.72 33.4 Favored 'General case' 0 N--CA 1.42 -1.932 0 N-CA-C 116.318 1.969 . . . . 0.0 116.318 -164.82 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -65.71 -16.97 64.27 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 118.483 -0.77 . . . . 0.0 111.675 170.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 10.8 mmpt? -80.4 -43.88 20.29 Favored 'General case' 0 C--N 1.345 0.385 0 CA-C-N 119.493 1.042 . . . . 0.0 109.343 166.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -57.32 -31.14 65.39 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 118.275 0.488 . . . . 0.0 111.382 173.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -61.59 -36.26 80.2 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 124.352 1.061 . . . . 0.0 109.902 178.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -63.79 -39.07 93.35 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 118.392 0.542 . . . . 0.0 110.194 175.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 27.4 tp10 -61.04 -52.76 63.59 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.759 0.424 . . . . 0.0 110.885 169.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -70.96 -26.79 63.32 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 118.886 -0.578 . . . . 0.0 112.447 -170.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 28.7 mt -58.24 -22.46 52.3 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 118.638 -0.696 . . . . 0.0 112.273 171.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 26.2 p -74.44 -51.32 15.25 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 119.252 0.933 . . . . 0.0 110.183 169.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -57.88 -49.24 77.39 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 126.212 1.805 . . . . 0.0 111.081 -178.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt -148.71 96.37 2.57 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 127.527 2.331 . . . . 0.0 107.094 -177.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 7.6 m -63.79 -21.09 66.26 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 114.237 1.199 . . . . 0.0 114.237 179.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.0 32.89 0.08 Allowed 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 129.029 2.931 . . . . 0.0 111.761 167.587 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 22.4 m -68.1 138.76 55.99 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 125.432 1.493 . . . . 0.0 109.803 177.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.7 pttm . . . . . 0 N--CA 1.449 -0.476 0 C-N-CA 125.35 1.46 . . . . 0.0 108.894 -173.206 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.9 mmm . . . . . 0 CA--C 1.539 0.535 0 CA-C-O 118.035 -0.984 . . . . 0.0 109.227 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -50.98 131.83 36.0 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 124.228 3.285 . . . . 0.0 112.883 179.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -141.98 -171.27 3.32 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 127.443 2.297 . . . . 0.0 107.688 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.11 124.39 11.4 Favored 'General case' 0 C--N 1.344 0.348 0 N-CA-C 106.027 -1.842 . . . . 0.0 106.027 168.537 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.429 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 40.3 t0 -89.16 106.05 12.21 Favored Pre-proline 0 CA--C 1.543 0.705 0 C-N-CA 123.539 0.736 . . . . 0.0 109.938 -165.297 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.455 ' HD3' ' HE ' ' A' ' 46' ' ' ARG . 23.6 Cg_exo -66.22 -32.04 43.2 Favored 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 125.073 3.849 . . . . 0.0 112.593 -174.499 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.453 ' HB3' ' CD2' ' A' ' 35' ' ' LEU . 99.1 m -93.85 -16.05 24.46 Favored 'General case' 0 N--CA 1.437 -1.075 0 C-N-CA 124.78 1.232 . . . . 0.0 112.562 -167.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 20.7 tp60 -59.67 -25.56 64.83 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 123.731 0.812 . . . . 0.0 111.114 177.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 51.5 tttm -61.03 -57.27 13.28 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.629 1.172 . . . . 0.0 110.097 168.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -61.64 -40.24 94.21 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.687 0.795 . . . . 0.0 110.392 -176.437 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.01 -45.89 52.33 Favored 'General case' 0 C--N 1.341 0.204 0 C-N-CA 125.334 1.454 . . . . 0.0 112.226 169.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 86.4 m -59.54 -45.46 91.72 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.738 -0.21 . . . . 0.0 110.642 175.517 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -60.4 -30.68 69.75 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 118.534 -0.746 . . . . 0.0 111.529 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.1 mt -64.8 -49.56 79.5 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.568 0 CA-C-N 119.451 1.023 . . . . 0.0 110.316 177.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.8 mm-40 -54.66 -56.06 23.12 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 124.118 0.886 . . . . 0.0 109.127 176.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 7.9 mptt -66.02 -33.29 75.48 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 119.592 -0.843 . . . . 0.0 111.878 -176.369 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 13.1 t -54.11 -49.16 69.77 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-N 119.22 0.918 . . . . 0.0 108.536 168.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.55 -47.49 84.06 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 123.878 0.871 . . . . 0.0 110.126 179.022 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -56.23 -46.94 79.33 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.603 0.761 . . . . 0.0 111.223 174.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.35 -13.2 60.24 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.1 0.96 . . . . 0.0 113.556 176.091 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -121.68 8.02 10.02 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.674 1.19 . . . . 0.0 111.989 -173.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 59.12 40.18 22.18 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 122.392 1.091 . . . . 0.0 110.694 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.265 7.5 m-85 72.05 14.72 5.69 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 127.911 2.485 . . . . 0.0 114.635 168.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 63.5 mtm -68.82 85.44 0.32 Allowed 'General case' 0 N--CA 1.44 -0.964 0 C-N-CA 125.086 1.354 . . . . 0.0 110.117 169.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -55.54 -19.31 9.53 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.568 1.147 . . . . 0.0 111.456 169.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.6 m -59.28 -40.71 86.99 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 127.314 2.246 . . . . 0.0 112.1 169.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.2 mmtm -73.33 -47.13 45.05 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 124.409 1.084 . . . . 0.0 108.764 175.155 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 76.3 m -73.53 6.82 2.75 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 125.211 1.404 . . . . 0.0 112.458 -177.659 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.605 HE22 ' NH2' ' A' ' 63' ' ' ARG . 61.5 mm-40 -53.85 -37.42 63.64 Favored 'General case' 0 C--N 1.341 0.206 0 O-C-N 120.858 -1.151 . . . . 0.0 110.601 167.464 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.32 -51.33 69.97 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.919 0.888 . . . . 0.0 111.706 179.132 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 5.8 p -75.69 -26.34 17.99 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.775 0 C-N-CA 123.084 0.554 . . . . 0.0 110.199 -176.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.563 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 58.2 mt -62.22 -49.79 82.61 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 167.75 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.615 HE21 ' NH2' ' A' ' 36' ' ' ARG . 2.0 tt0 -54.87 -33.26 61.71 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 118.962 0.801 . . . . 0.0 111.66 175.37 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -68.6 -41.81 79.07 Favored 'General case' 0 N--CA 1.441 -0.918 0 CA-C-O 119.024 -0.512 . . . . 0.0 111.87 174.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.49 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.6 mt -63.57 -37.1 86.04 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 117.203 -1.38 . . . . 0.0 110.984 173.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.615 ' NH2' HE21 ' A' ' 33' ' ' GLN . 2.1 ptt180 -69.1 -40.93 78.09 Favored 'General case' 0 C--N 1.344 0.328 0 CA-C-N 120.625 1.557 . . . . 0.0 109.952 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -63.07 -41.48 99.45 Favored 'General case' 0 C--N 1.341 0.235 0 CA-C-O 119.457 -0.306 . . . . 0.0 111.17 175.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.1 t -57.42 -51.69 68.39 Favored 'General case' 0 C--O 1.22 -0.483 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 172.186 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.3 t -58.87 -48.3 81.87 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 124.417 1.087 . . . . 0.0 111.879 -172.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.78 -1.23 6.61 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.243 -0.89 . . . . 0.0 112.781 -177.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.545 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 20.1 tt0 -80.98 -10.96 59.65 Favored 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 124.208 1.003 . . . . 0.0 110.893 175.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.545 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 83.6 m-85 -135.07 157.88 76.0 Favored Pre-proline 0 N--CA 1.445 -0.715 0 C-N-CA 125.304 1.442 . . . . 0.0 110.807 -168.578 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -67.57 105.75 1.14 Allowed 'Trans proline' 0 N--CA 1.455 -0.783 0 N-CA-C 104.671 -2.857 . . . . 0.0 104.671 166.324 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 22.5 pttp -39.14 -38.74 0.51 Allowed 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 117.895 2.554 . . . . 0.0 117.895 -164.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.02 -15.09 19.69 Favored Glycine 0 CA--C 1.536 1.379 0 CA-C-N 119.365 0.984 . . . . 0.0 114.04 175.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.455 ' HE ' ' HD3' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -57.5 -27.44 62.54 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 126.281 1.833 . . . . 0.0 112.853 170.06 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.8 t -134.95 137.44 43.1 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-O 122.663 1.22 . . . . 0.0 110.865 -173.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 21.6 t -70.66 -55.9 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 CA-C-N 113.904 -1.498 . . . . 0.0 108.797 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 9.7 m -58.44 -43.02 85.77 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 CA-C-O 119.203 -0.427 . . . . 0.0 110.004 -178.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . 0.459 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 11.4 t -64.67 -35.67 81.78 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.764 1.625 . . . . 0.0 110.1 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 52.5 m -66.02 -25.5 67.09 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 118.959 -0.543 . . . . 0.0 110.921 172.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.42 -40.32 54.92 Favored Glycine 0 C--N 1.344 0.987 0 CA-C-O 123.935 1.853 . . . . 0.0 110.719 167.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.563 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 0.5 OUTLIER -69.45 -40.5 77.14 Favored 'General case' 0 N--CA 1.421 -1.924 0 C-N-CA 126.136 1.774 . . . . 0.0 115.564 -166.319 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -66.4 -16.96 64.5 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 118.704 -0.665 . . . . 0.0 111.507 174.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 47.6 mttp -80.54 -44.93 18.24 Favored 'General case' 0 C--N 1.347 0.463 0 CA-C-N 119.329 0.968 . . . . 0.0 109.306 166.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -58.97 -28.54 66.41 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 117.986 0.357 . . . . 0.0 111.82 173.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -61.45 -34.94 76.27 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.636 1.174 . . . . 0.0 109.844 177.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.3 tm-20 -61.18 -45.73 93.4 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 118.581 0.628 . . . . 0.0 109.393 173.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -56.03 -53.04 61.75 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 117.838 0.29 . . . . 0.0 110.655 171.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -68.73 -29.13 67.48 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 122.958 0.503 . . . . 0.0 111.997 -170.282 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 34.8 mt -62.02 -24.13 66.86 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.889 0.876 . . . . 0.0 112.46 169.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 29.6 p -83.99 -43.95 14.66 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 119.659 1.118 . . . . 0.0 110.687 169.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.605 ' NH2' HE22 ' A' ' 29' ' ' GLN . 23.6 ttp180 -66.33 -25.73 66.96 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.76 1.624 . . . . 0.0 112.909 -177.192 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 62.7 mtpt 51.46 35.96 15.56 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 129.025 2.93 . . . . 0.0 113.699 172.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 5.7 p -69.02 146.88 52.31 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 123.126 0.57 . . . . 0.0 111.127 173.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -135.48 140.16 44.61 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 126.281 1.832 . . . . 0.0 107.823 176.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 29.1 m -174.76 -166.48 0.25 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 126.755 2.022 . . . . 0.0 108.674 -173.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 58.6 pttt . . . . . 0 CA--C 1.533 0.322 0 C-N-CA 124.549 1.14 . . . . 0.0 110.896 172.889 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 88.4 mmm . . . . . 0 CA--C 1.539 0.522 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -49.52 128.7 21.38 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 123.33 2.687 . . . . 0.0 111.373 174.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 19.4 mm100 -70.7 70.12 0.45 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.895 1.678 . . . . 0.0 110.996 -179.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.6 ptpt -71.95 -170.18 0.55 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 126.768 2.027 . . . . 0.0 109.488 168.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -139.78 88.31 12.27 Favored Pre-proline 0 CA--C 1.536 0.406 0 O-C-N 121.213 -0.929 . . . . 0.0 108.827 168.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -57.19 -31.06 89.46 Favored 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 124.039 3.159 . . . . 0.0 112.901 -175.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 54.7 m -94.27 -10.47 32.76 Favored 'General case' 0 N--CA 1.437 -1.108 0 C-N-CA 125.362 1.465 . . . . 0.0 113.052 -169.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 27.7 tp60 -63.21 -24.54 67.92 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 118.447 0.567 . . . . 0.0 111.256 -179.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.6 tppt? -60.48 -53.76 53.65 Favored 'General case' 0 C--N 1.339 0.132 0 C-N-CA 122.991 0.517 . . . . 0.0 109.97 169.276 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -62.49 -39.66 94.2 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.551 0.741 . . . . 0.0 110.004 -177.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -53.97 -45.9 71.52 Favored 'General case' 0 C--N 1.343 0.308 0 C-N-CA 125.044 1.338 . . . . 0.0 112.34 169.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 67.6 m -57.92 -42.76 85.47 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 121.333 -0.147 . . . . 0.0 110.786 174.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -65.04 -22.7 67.02 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-O 117.604 -1.189 . . . . 0.0 112.706 178.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 27.8 mm -59.41 -52.83 56.25 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.244 0 CA-C-N 120.515 1.507 . . . . 0.0 108.962 172.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 33.7 mm-40 -58.34 -53.97 52.24 Favored 'General case' 0 N--CA 1.442 -0.828 0 O-C-N 123.989 0.806 . . . . 0.0 109.051 178.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 57.1 mmtt -68.17 -30.93 70.15 Favored 'General case' 0 N--CA 1.457 -0.078 0 C-N-CA 118.507 -1.277 . . . . 0.0 111.555 -173.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 19.4 t -56.85 -48.73 77.41 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 168.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.93 -46.73 84.59 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 123.203 0.601 . . . . 0.0 110.53 179.353 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -57.16 -45.78 83.32 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.751 0.821 . . . . 0.0 111.231 174.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.98 -12.47 55.22 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 175.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -124.38 8.56 8.43 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.695 1.198 . . . . 0.0 112.387 -172.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 58.49 40.1 24.3 Favored 'General case' 0 C--N 1.345 0.393 0 CA-C-O 122.418 1.104 . . . . 0.0 110.913 179.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.259 7.0 m-85 71.88 13.7 6.02 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 127.826 2.45 . . . . 0.0 114.692 168.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 66.0 mtm -69.98 85.59 0.52 Allowed 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 125.051 1.34 . . . . 0.0 109.791 170.115 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -54.04 -24.93 18.89 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.283 0.633 . . . . 0.0 111.504 171.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.2 m -52.63 -40.33 62.66 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 126.293 1.837 . . . . 0.0 112.297 170.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.1 mmtm -71.79 -46.42 58.37 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.212 1.005 . . . . 0.0 108.794 174.218 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.7 m -74.67 5.29 5.03 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 124.749 1.219 . . . . 0.0 113.222 -173.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 -57.66 -26.8 62.18 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 119.196 0.907 . . . . 0.0 110.674 166.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.55 -55.7 31.18 Favored 'General case' 0 C--N 1.346 0.446 0 C-N-CA 126.21 1.804 . . . . 0.0 111.709 171.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.6 p -76.07 -27.02 17.75 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.69 0 C-N-CA 123.693 0.797 . . . . 0.0 109.759 -175.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 26.4 mt -62.41 -45.9 97.68 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 168.086 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -52.13 -36.9 52.65 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 118.755 0.707 . . . . 0.0 111.265 171.698 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -71.55 -43.38 66.49 Favored 'General case' 0 N--CA 1.433 -1.311 0 CA-C-O 118.633 -0.699 . . . . 0.0 111.678 178.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.496 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.3 mt -63.37 -31.73 72.96 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 119.637 1.108 . . . . 0.0 110.668 173.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.456 HH11 ' HG3' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -60.67 -58.47 8.32 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.495 1.118 . . . . 0.0 108.783 177.363 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 55.9 mtpt -62.32 -35.64 79.7 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 113.862 -1.517 . . . . 0.0 111.143 -178.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 41.8 t -60.9 -51.83 67.6 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 170.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 51.5 t -62.79 -49.16 76.08 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 123.406 0.682 . . . . 0.0 111.647 -170.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.05 -1.39 5.79 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.111 -0.95 . . . . 0.0 112.551 -177.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.435 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 2.2 tp-100 -84.5 -7.18 59.36 Favored 'General case' 0 N--CA 1.435 -1.194 0 C-N-CA 124.735 1.214 . . . . 0.0 111.476 177.298 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.435 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 72.9 m-85 -139.67 160.72 60.09 Favored Pre-proline 0 N--CA 1.446 -0.644 0 C-N-CA 124.705 1.202 . . . . 0.0 111.23 -169.43 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -67.29 120.14 7.19 Favored 'Trans proline' 0 N--CA 1.455 -0.788 0 N-CA-C 105.36 -2.592 . . . . 0.0 105.36 165.295 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -47.73 -32.11 5.49 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 116.086 1.884 . . . . 0.0 116.086 -167.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.33 -15.12 36.88 Favored Glycine 0 CA--C 1.536 1.364 0 CA-C-N 118.782 0.719 . . . . 0.0 113.769 176.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.89 -11.41 46.76 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 126.055 1.742 . . . . 0.0 112.419 170.058 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.0 t -153.74 136.75 15.49 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-O 123.104 1.43 . . . . 0.0 113.058 -178.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.0 t -70.52 -53.51 22.28 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 CA-C-N 113.463 -1.699 . . . . 0.0 108.798 176.269 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.9 m -59.73 -41.69 86.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-O 119.264 -0.398 . . . . 0.0 110.029 -178.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . 0.447 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 10.7 t -64.42 -37.45 87.57 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.51 1.524 . . . . 0.0 110.16 177.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 48.8 m -66.17 -23.58 66.49 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 118.949 -0.548 . . . . 0.0 111.264 173.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -77.01 -25.85 63.44 Favored Glycine 0 C--N 1.346 1.089 0 CA-C-O 123.194 1.441 . . . . 0.0 111.781 168.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.496 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -81.67 -41.67 21.05 Favored 'General case' 0 N--CA 1.428 -1.538 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 -166.114 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -68.17 -23.52 64.87 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 119.174 -0.441 . . . . 0.0 110.647 171.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 17.3 tppt? -69.73 -44.68 69.78 Favored 'General case' 0 C--N 1.345 0.398 0 CA-C-N 118.888 0.767 . . . . 0.0 109.25 167.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -59.57 -31.8 69.78 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 118.807 0.731 . . . . 0.0 111.754 170.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -66.08 -55.63 15.56 Favored 'General case' 0 N--CA 1.456 -0.155 0 O-C-N 120.754 -1.216 . . . . 0.0 108.42 175.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -55.23 -36.56 66.14 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.518 0.727 . . . . 0.0 111.522 177.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -56.83 -58.32 8.63 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 124.703 1.201 . . . . 0.0 109.962 174.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 49.6 m-80 -75.08 -28.1 60.18 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -170.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 60.8 mt -56.47 -22.46 32.57 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 118.215 -0.898 . . . . 0.0 112.818 170.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 52.4 p -64.6 -47.28 79.24 Favored 'General case' 0 C--N 1.344 0.329 0 CA-C-N 119.919 1.236 . . . . 0.0 110.885 171.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.37 -57.67 8.67 Favored 'General case' 0 C--N 1.338 0.091 0 C-N-CA 124.247 1.019 . . . . 0.0 110.901 177.134 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.7 tppp? -158.33 157.59 32.69 Favored 'General case' 0 C--O 1.224 -0.249 0 C-N-CA 122.916 0.486 . . . . 0.0 110.042 -175.329 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 5.6 m -64.07 -18.74 64.67 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 115.056 1.502 . . . . 0.0 115.056 176.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -63.97 115.79 5.23 Favored 'General case' 0 C--N 1.317 -0.804 0 C-N-CA 128.276 2.631 . . . . 0.0 109.547 170.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 5.6 p -68.5 42.11 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 127.799 2.44 . . . . 0.0 113.928 -177.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 20.5 pttp . . . . . 0 CA--C 1.539 0.52 0 O-C-N 120.264 -1.522 . . . . 0.0 111.695 174.789 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.7 mtm . . . . . 0 CA--C 1.54 0.56 0 CA-C-O 118.817 -0.611 . . . . 0.0 110.054 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -73.18 69.3 3.99 Favored 'Trans proline' 0 CA--C 1.539 0.725 0 C-N-CA 124.534 3.49 . . . . 0.0 110.482 173.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 -64.28 -29.17 70.27 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.705 1.602 . . . . 0.0 111.769 -174.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 18.4 ptmt -72.78 65.72 0.72 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.12 1.368 . . . . 0.0 109.341 168.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -94.57 105.34 17.78 Favored Pre-proline 0 CA--C 1.541 0.599 0 C-N-CA 128.02 2.528 . . . . 0.0 110.993 -167.6 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -55.08 -31.93 77.26 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 124.177 3.251 . . . . 0.0 113.228 -178.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 84.4 m -96.77 -11.01 25.54 Favored 'General case' 0 N--CA 1.438 -1.073 0 C-N-CA 126.013 1.725 . . . . 0.0 113.6 -169.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.1 tp60 -64.12 -26.03 68.36 Favored 'General case' 0 N--CA 1.444 -0.775 0 CA-C-N 118.294 0.497 . . . . 0.0 110.721 -179.158 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.6 tptt -59.91 -56.11 25.84 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.537 0.735 . . . . 0.0 109.811 169.395 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -60.72 -39.7 89.58 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.117 0.567 . . . . 0.0 109.932 -177.192 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.43 -41.81 85.89 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.991 1.316 . . . . 0.0 112.451 171.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 98.3 m -59.71 -44.13 93.82 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.673 0.67 . . . . 0.0 110.627 171.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -64.97 -20.11 66.32 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 117.69 -1.148 . . . . 0.0 112.44 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 29.6 mm -59.04 -54.09 38.93 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 CA-C-N 120.538 1.517 . . . . 0.0 109.186 170.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 6.7 mm-40 -60.49 -53.38 58.27 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 -178.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 24.6 mttm -68.0 -30.29 69.51 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 118.222 -0.894 . . . . 0.0 111.583 -173.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 15.7 t -58.28 -47.73 82.69 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 119.386 0.994 . . . . 0.0 108.52 168.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.69 -46.83 83.8 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 118.843 -0.599 . . . . 0.0 110.282 178.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -57.55 -44.63 85.34 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.558 0.743 . . . . 0.0 111.419 173.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.85 -13.23 61.38 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 175.143 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 -123.67 8.22 8.86 Favored 'General case' 0 C--N 1.343 0.301 0 C-N-CA 124.725 1.21 . . . . 0.0 112.277 -172.365 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.3 m 58.84 40.14 23.16 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 122.37 1.081 . . . . 0.0 110.774 179.715 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.26 7.1 m-85 72.02 13.93 5.83 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 127.816 2.446 . . . . 0.0 114.563 168.681 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 68.1 mtm -70.77 83.27 0.64 Allowed 'General case' 0 N--CA 1.441 -0.881 0 C-N-CA 125.293 1.437 . . . . 0.0 109.777 170.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -54.41 -23.57 16.37 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.914 0.886 . . . . 0.0 111.79 172.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 4.3 m -51.98 -42.82 63.24 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 126.096 1.758 . . . . 0.0 111.907 169.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 48.4 mmtt -69.54 -48.02 61.79 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 124.559 1.144 . . . . 0.0 108.891 175.204 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.0 m -72.27 1.27 7.99 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 124.584 1.154 . . . . 0.0 113.307 -173.615 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 86.7 mm-40 -55.94 -26.77 49.35 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.477 1.035 . . . . 0.0 111.139 166.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.47 -57.9 10.91 Favored 'General case' 0 C--N 1.347 0.466 0 C-N-CA 125.5 1.52 . . . . 0.0 111.677 171.198 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 14.0 p -74.82 -29.47 22.8 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.76 0 C-N-CA 123.68 0.792 . . . . 0.0 110.145 -173.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.433 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 63.8 mt -58.77 -50.83 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.649 0 N-CA-C 105.402 -2.073 . . . . 0.0 105.402 167.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.403 ' HA ' ' HG3' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -56.28 -35.48 67.53 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 119.232 0.923 . . . . 0.0 112.869 175.077 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -68.31 -35.31 77.63 Favored 'General case' 0 N--CA 1.438 -1.05 0 C-N-CA 118.995 -1.082 . . . . 0.0 110.027 179.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.493 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -65.79 -26.33 67.65 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 125.155 1.382 . . . . 0.0 109.885 173.311 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.403 ' HG3' ' HA ' ' A' ' 33' ' ' GLN . 20.0 mmt85 -71.28 -50.92 27.72 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 177.534 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 67.2 mmtt -65.87 -25.08 67.02 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.247 179.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 47.6 t -70.36 -55.17 9.77 Favored 'General case' 0 N--CA 1.441 -0.922 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 167.257 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.3 t -60.27 -46.93 88.1 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 121.234 -0.916 . . . . 0.0 112.656 -170.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.12 2.05 6.48 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -175.188 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.57 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 11.6 tt0 -90.36 -8.99 49.34 Favored 'General case' 0 N--CA 1.442 -0.837 0 C-N-CA 126.123 1.769 . . . . 0.0 111.234 -175.681 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.57 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 74.9 m-85 -139.45 160.61 61.01 Favored Pre-proline 0 N--CA 1.445 -0.706 0 C-N-CA 124.637 1.175 . . . . 0.0 111.978 -167.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -66.12 127.97 18.64 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 N-CA-C 105.574 -2.51 . . . . 0.0 105.574 165.065 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -53.24 -32.26 47.46 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 114.271 1.211 . . . . 0.0 114.271 -166.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.82 -9.13 18.37 Favored Glycine 0 CA--C 1.535 1.343 0 C-N-CA 124.566 1.079 . . . . 0.0 114.236 175.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.3 tpm_? -68.44 -17.37 64.19 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 126.172 1.789 . . . . 0.0 112.406 169.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.9 t -149.97 137.95 20.25 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 122.641 1.21 . . . . 0.0 113.306 -170.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 26.2 t -70.11 -56.35 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 113.536 -1.665 . . . . 0.0 108.726 172.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 12.5 m -62.87 -41.72 93.71 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 CA-C-O 118.637 -0.696 . . . . 0.0 110.397 -172.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 28.0 t -63.06 -33.81 76.23 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.244 1.418 . . . . 0.0 110.118 176.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 56.9 m -67.92 -21.09 65.13 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 118.549 -0.739 . . . . 0.0 111.363 172.413 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -75.38 -39.95 34.56 Favored Glycine 0 C--N 1.344 1.004 0 CA-C-O 124.202 2.001 . . . . 0.0 110.796 166.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.493 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 1.2 t80 -73.92 -40.55 63.05 Favored 'General case' 0 N--CA 1.417 -2.097 0 CA-C-N 112.016 -2.092 . . . . 0.0 116.546 -163.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -64.01 -25.53 68.17 Favored 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 119.86 -0.736 . . . . 0.0 110.937 170.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 39.4 mmtm -72.12 -37.55 69.46 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-N 119.231 0.923 . . . . 0.0 110.036 168.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -58.06 -42.65 85.92 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.041 0.537 . . . . 0.0 110.498 171.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -64.88 -41.74 95.4 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 124.277 1.031 . . . . 0.0 110.734 179.107 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -61.01 -43.34 99.03 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 118.199 0.454 . . . . 0.0 110.853 170.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -58.99 -38.22 78.65 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 123.584 0.753 . . . . 0.0 111.385 174.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -62.08 -30.9 71.31 Favored 'General case' 0 CA--C 1.521 -0.149 0 C-N-CA 123.855 0.862 . . . . 0.0 112.368 -176.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 64.3 mt -54.23 -27.2 33.07 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.355 0.662 . . . . 0.0 112.13 170.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 29.8 p -94.38 -45.28 7.53 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.619 1.568 . . . . 0.0 110.905 173.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 35.5 ttp85 -61.5 -26.7 68.08 Favored 'General case' 0 N--CA 1.461 0.096 0 C-N-CA 125.8 1.64 . . . . 0.0 112.517 -174.03 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.5 pptp? -61.55 4.47 0.1 Allowed 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 116.242 1.941 . . . . 0.0 116.242 176.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 13.1 p -74.19 -165.89 0.36 Allowed 'General case' 0 N--CA 1.443 -0.804 0 C-N-CA 128.88 2.872 . . . . 0.0 108.846 167.244 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -61.21 92.83 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.275 1.03 . . . . 0.0 110.948 175.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 53.5 p -151.74 -163.48 1.76 Allowed 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.559 1.944 . . . . 0.0 108.905 -179.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 29.3 mtmm . . . . . 0 N--CA 1.466 0.339 0 C-N-CA 125.605 1.562 . . . . 0.0 111.809 172.515 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 mpp? . . . . . 0 CA--C 1.54 0.595 0 CA-C-O 119.102 -0.475 . . . . 0.0 109.835 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo -78.4 60.68 7.61 Favored 'Trans proline' 0 CA--C 1.544 0.998 0 C-N-CA 123.633 2.889 . . . . 0.0 111.863 -174.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -69.43 83.19 0.39 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 127.356 2.263 . . . . 0.0 110.732 -169.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.6 mttt 50.24 16.95 0.29 Allowed 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 128.289 2.635 . . . . 0.0 113.864 -169.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -144.86 98.01 4.86 Favored Pre-proline 0 N--CA 1.439 -0.979 0 C-N-CA 129.98 3.312 . . . . 0.0 104.437 -169.025 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -56.21 -30.04 78.2 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 123.91 3.073 . . . . 0.0 112.702 -169.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 69.7 m -94.25 -10.89 31.47 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.56 1.544 . . . . 0.0 112.772 -171.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 22.2 tp60 -63.94 -25.09 67.98 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 118.618 0.645 . . . . 0.0 111.045 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 46.3 tttm -59.76 -55.9 28.5 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.624 1.17 . . . . 0.0 110.024 168.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 -65.25 -33.76 76.76 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.016 0.527 . . . . 0.0 110.072 -178.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -62.52 -40.27 96.24 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.535 0.734 . . . . 0.0 112.102 172.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 74.2 m -59.03 -44.97 91.81 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.411 0.55 . . . . 0.0 110.017 171.045 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -60.05 -28.1 67.49 Favored 'General case' 0 C--O 1.226 -0.133 0 CA-C-O 117.739 -1.124 . . . . 0.0 112.037 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 43.8 mm -57.76 -55.29 22.42 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.248 0 CA-C-N 120.013 1.279 . . . . 0.0 109.703 173.052 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -57.83 -55.15 38.61 Favored 'General case' 0 N--CA 1.444 -0.725 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 -178.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.6 mptp? -66.98 -31.99 72.92 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 118.824 -1.151 . . . . 0.0 111.789 -174.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 21.2 t -56.14 -48.46 76.21 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 119.532 1.06 . . . . 0.0 108.746 169.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.62 -47.02 85.76 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 123.208 0.603 . . . . 0.0 110.5 179.565 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -57.04 -45.79 82.9 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.608 0.763 . . . . 0.0 111.197 174.367 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.71 -13.12 58.65 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.128 0.971 . . . . 0.0 113.406 175.627 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 -123.66 8.89 8.89 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 124.579 1.152 . . . . 0.0 112.197 -173.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 57.91 40.31 25.91 Favored 'General case' 0 C--N 1.345 0.41 0 CA-C-O 122.437 1.113 . . . . 0.0 110.989 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.262 6.8 m-85 72.34 13.93 5.5 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 127.803 2.441 . . . . 0.0 114.445 168.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 68.5 mtm -70.67 84.51 0.63 Allowed 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 125.118 1.367 . . . . 0.0 109.866 170.622 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -53.89 -24.01 14.62 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.892 0.877 . . . . 0.0 111.679 171.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.7 m -53.37 -40.37 64.94 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.028 1.731 . . . . 0.0 112.304 170.462 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 51.8 mmtt -71.92 -47.48 52.27 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.375 1.07 . . . . 0.0 108.778 174.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 71.6 m -72.53 1.89 7.33 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.771 1.229 . . . . 0.0 113.356 -174.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 74.7 mm-40 -54.76 -27.54 41.92 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 119.587 1.085 . . . . 0.0 110.911 167.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.47 -57.63 12.14 Favored 'General case' 0 C--N 1.347 0.467 0 C-N-CA 126.011 1.724 . . . . 0.0 111.961 172.48 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.0 p -74.41 -29.73 24.71 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.722 0 C-N-CA 123.712 0.805 . . . . 0.0 109.7 -174.333 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.617 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 72.5 mt -61.74 -45.33 98.92 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 169.207 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.64 -38.73 69.93 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 118.702 0.683 . . . . 0.0 111.914 172.551 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -70.93 -40.22 72.21 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 118.482 -1.287 . . . . 0.0 109.966 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.504 HD13 ' CE1' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -66.13 -26.78 67.6 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.877 0.871 . . . . 0.0 109.786 178.026 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.71 -56.03 12.42 Favored 'General case' 0 CA--C 1.513 -0.443 0 C-N-CA 125.193 1.397 . . . . 0.0 108.578 176.38 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 7.9 mptt -61.01 -32.53 72.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 113.519 -1.673 . . . . 0.0 110.436 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 47.4 t -63.94 -55.97 18.61 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 168.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 52.8 t -58.89 -46.54 87.62 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 124.007 0.923 . . . . 0.0 112.457 -170.097 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.87 -3.01 13.9 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.249 -0.887 . . . . 0.0 112.833 -177.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.453 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 3.1 tp-100 -86.46 -5.74 59.08 Favored 'General case' 0 N--CA 1.438 -1.052 0 C-N-CA 124.57 1.148 . . . . 0.0 111.71 -177.346 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.453 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 79.5 m-85 -138.2 159.78 66.77 Favored Pre-proline 0 N--CA 1.444 -0.747 0 C-N-CA 124.531 1.132 . . . . 0.0 111.261 -168.652 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -66.97 113.11 2.68 Favored 'Trans proline' 0 N--CA 1.454 -0.845 0 N-CA-C 105.159 -2.67 . . . . 0.0 105.159 165.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 39.6 mmtm -42.75 -35.62 1.2 Allowed 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 116.306 1.965 . . . . 0.0 116.306 -166.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.68 -15.86 20.56 Favored Glycine 0 CA--C 1.539 1.548 0 C-N-CA 124.629 1.109 . . . . 0.0 114.266 175.188 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.2 tpm_? -58.51 -24.22 59.99 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.745 2.018 . . . . 0.0 111.835 169.484 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 8.1 t -145.2 130.72 18.81 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-O 123.359 1.552 . . . . 0.0 112.787 -169.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.4 t -68.74 -50.71 52.62 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 CA-C-N 112.681 -2.054 . . . . 0.0 108.566 176.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.9 m -61.0 -45.37 98.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 CA-C-O 118.555 -0.735 . . . . 0.0 109.592 -178.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 24.4 t -61.65 -35.14 77.1 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.299 1.84 . . . . 0.0 110.304 178.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.6 m -66.96 -26.34 66.78 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.188 0.595 . . . . 0.0 111.303 172.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.84 -30.87 60.9 Favored Glycine 0 C--N 1.344 1.01 0 CA-C-O 123.437 1.576 . . . . 0.0 111.731 168.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.617 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 0.6 OUTLIER -81.36 -41.16 22.41 Favored 'General case' 0 N--CA 1.424 -1.733 0 N-CA-C 117.39 2.367 . . . . 0.0 117.39 -164.393 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -65.5 -27.84 68.76 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 118.9 -0.571 . . . . 0.0 109.565 168.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 55.6 mttp -70.78 -35.08 72.41 Favored 'General case' 0 C--N 1.348 0.51 0 CA-C-N 119.236 0.926 . . . . 0.0 110.285 167.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.91 -35.15 75.94 Favored 'General case' 0 C--O 1.22 -0.497 0 CA-C-N 119.132 0.878 . . . . 0.0 110.266 169.559 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -63.56 -44.63 93.56 Favored 'General case' 0 CA--C 1.531 0.22 0 O-C-N 120.99 -1.069 . . . . 0.0 110.394 174.62 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -58.92 -40.81 85.7 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 118.644 0.656 . . . . 0.0 110.893 171.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -62.15 -40.17 95.07 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.648 0.779 . . . . 0.0 111.387 173.774 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -63.01 -42.96 99.95 Favored 'General case' 0 CA--C 1.529 0.158 0 O-C-N 120.848 -1.158 . . . . 0.0 109.743 175.255 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 80.9 mt -64.22 -43.18 95.78 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 123.184 0.593 . . . . 0.0 110.199 -178.42 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.06 -39.54 90.18 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 119.479 -0.296 . . . . 0.0 110.577 174.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 10.8 mmp_? -67.52 -29.62 69.07 Favored 'General case' 0 C--N 1.342 0.259 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 179.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 81.3 mttt -69.38 47.46 0.07 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.631 1.572 . . . . 0.0 110.943 168.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 59.7 p -145.33 175.92 9.94 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 127.121 2.169 . . . . 0.0 109.044 174.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -63.61 72.81 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 127.075 2.15 . . . . 0.0 112.207 -177.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 49.6 m -80.82 63.65 5.3 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 126.667 1.987 . . . . 0.0 110.741 -169.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 59.3 mtmt . . . . . 0 N--CA 1.465 0.31 0 C-N-CA 125.184 1.394 . . . . 0.0 110.685 -178.552 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.0 mtt . . . . . 0 C--O 1.239 0.523 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -63.75 159.09 43.08 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.368 2.045 . . . . 0.0 110.321 172.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 96.0 mm-40 -129.41 163.03 26.71 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 125.359 1.463 . . . . 0.0 110.281 -169.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 22.8 ptmt -145.78 -178.57 6.17 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 125.18 1.392 . . . . 0.0 110.201 178.065 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -135.69 88.75 23.08 Favored Pre-proline 0 CA--C 1.538 0.481 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 168.557 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -60.27 -32.9 94.86 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 123.747 2.965 . . . . 0.0 112.802 -171.208 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 96.3 m -94.14 -12.19 28.9 Favored 'General case' 0 N--CA 1.437 -1.099 0 C-N-CA 124.475 1.11 . . . . 0.0 113.144 -168.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 18.8 tp60 -61.38 -26.79 68.07 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 122.756 0.422 . . . . 0.0 110.833 177.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 51.9 tptt -60.05 -57.7 11.69 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.451 0.7 . . . . 0.0 109.807 168.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -60.28 -37.52 80.73 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 122.983 0.513 . . . . 0.0 110.317 -176.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -60.43 -35.82 76.73 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.465 1.106 . . . . 0.0 113.037 172.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 75.8 m -64.07 -44.49 92.23 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 118.343 0.52 . . . . 0.0 110.396 169.351 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.4 mm-40 -64.1 -25.09 67.95 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 117.955 -1.022 . . . . 0.0 112.28 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.418 HD13 HG13 ' A' ' 31' ' ' VAL . 46.8 mm -56.44 -50.5 72.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.243 0 CA-C-N 119.964 1.256 . . . . 0.0 109.409 169.251 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 -60.78 -55.39 33.74 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 -175.543 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 48.1 mttt -69.94 -30.58 68.0 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 118.245 -0.884 . . . . 0.0 111.425 -172.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 17.3 t -57.14 -46.76 82.42 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 168.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.05 -45.95 89.48 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 118.49 -0.767 . . . . 0.0 110.354 179.025 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -58.28 -45.27 88.21 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 119.177 0.899 . . . . 0.0 111.282 174.235 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.07 -13.53 58.21 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.048 0.939 . . . . 0.0 113.306 175.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -124.38 9.04 8.46 Favored 'General case' 0 C--N 1.343 0.289 0 C-N-CA 124.425 1.09 . . . . 0.0 112.351 -172.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.6 m 57.83 40.45 26.04 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 122.464 1.126 . . . . 0.0 110.814 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.256 6.8 m-85 72.01 13.98 5.84 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 127.852 2.461 . . . . 0.0 114.44 168.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 66.1 mtm -70.23 85.6 0.57 Allowed 'General case' 0 N--CA 1.44 -0.931 0 C-N-CA 125.132 1.373 . . . . 0.0 109.723 169.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -53.37 -25.69 16.45 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.312 0.645 . . . . 0.0 111.381 170.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.1 m -52.31 -38.86 59.62 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 126.744 2.018 . . . . 0.0 112.675 170.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.7 mmtm -74.17 -47.51 35.33 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.369 1.068 . . . . 0.0 108.69 173.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.2 m -71.71 0.89 7.72 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 124.892 1.277 . . . . 0.0 113.281 -174.496 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 51.6 mm-40 -54.72 -28.26 46.8 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 119.652 1.114 . . . . 0.0 110.242 166.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.59 -56.65 19.44 Favored 'General case' 0 C--N 1.346 0.441 0 C-N-CA 125.789 1.636 . . . . 0.0 111.906 171.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.418 HG13 HD13 ' A' ' 14' ' ' ILE . 13.4 p -75.77 -28.34 19.31 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.835 0 C-N-CA 123.288 0.635 . . . . 0.0 110.002 -174.113 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.478 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 60.0 mt -61.91 -45.85 97.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 N-CA-C 106.564 -1.643 . . . . 0.0 106.564 168.725 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.92 -38.41 70.24 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 119.202 0.91 . . . . 0.0 112.284 171.129 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -70.26 -37.85 74.98 Favored 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 119.354 -0.938 . . . . 0.0 110.085 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.551 HD13 ' CE1' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -65.28 -30.81 71.71 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 124.673 1.189 . . . . 0.0 108.834 174.957 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.0 mmt-85 -69.96 -49.89 47.31 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -61.02 -35.43 76.85 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-N 114.895 -1.048 . . . . 0.0 110.698 177.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 51.0 t -61.81 -57.17 12.89 Favored 'General case' 0 C--O 1.219 -0.551 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 168.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 35.4 t -58.39 -44.29 88.89 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 123.856 0.862 . . . . 0.0 112.144 -169.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.41 -1.21 10.01 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 124.03 0.932 . . . . 0.0 113.296 -178.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.555 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 15.5 tt0 -83.87 -8.85 59.1 Favored 'General case' 0 N--CA 1.444 -0.764 0 C-N-CA 124.435 1.094 . . . . 0.0 111.105 176.902 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.555 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 90.6 m-85 -138.97 158.02 70.49 Favored Pre-proline 0 N--CA 1.441 -0.894 0 C-N-CA 124.979 1.312 . . . . 0.0 112.106 -166.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -69.86 111.06 2.73 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 N-CA-C 104.968 -2.743 . . . . 0.0 104.968 165.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 64.3 pttt -42.01 -32.57 0.46 Allowed 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 117.964 2.579 . . . . 0.0 117.964 -166.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -56.47 -15.76 12.95 Favored Glycine 0 CA--C 1.538 1.509 0 CA-C-N 119.468 1.031 . . . . 0.0 114.177 172.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 5.0 tpm_? -54.05 -24.74 18.31 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 127.583 2.353 . . . . 0.0 112.132 168.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.3 t -146.76 137.74 24.05 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-O 122.73 1.252 . . . . 0.0 111.82 -170.392 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 18.7 t -66.84 -53.71 31.98 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.677 0 CA-C-N 113.491 -1.686 . . . . 0.0 108.487 177.172 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 3.8 m -60.26 -46.08 95.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-O 118.47 -0.776 . . . . 0.0 109.415 -178.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 41.9 t -63.31 -30.22 71.39 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.125 1.37 . . . . 0.0 109.943 -178.258 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 52.3 m -68.45 -27.48 66.21 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.186 0.595 . . . . 0.0 111.277 172.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -71.08 -40.42 61.98 Favored Glycine 0 N--CA 1.473 1.113 0 CA-C-O 124.781 2.323 . . . . 0.0 110.752 167.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.551 ' CE1' HD13 ' A' ' 35' ' ' LEU . 2.0 t80 -77.54 -35.88 52.87 Favored 'General case' 0 N--CA 1.41 -2.468 0 CA-C-N 111.22 -2.49 . . . . 0.0 116.677 -163.214 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -65.61 -28.09 68.88 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 118.258 -0.877 . . . . 0.0 110.909 169.363 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.408 ' HA ' ' HE2' ' A' ' 55' ' ' LYS . 0.1 OUTLIER -66.51 -42.5 87.21 Favored 'General case' 0 C--N 1.346 0.433 0 CA-C-N 119.731 1.151 . . . . 0.0 109.367 168.981 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -58.09 -46.94 84.66 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.51 0.724 . . . . 0.0 110.765 174.055 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 48.3 tt0 -64.24 -45.63 87.33 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 125.903 1.681 . . . . 0.0 109.93 -176.648 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -60.15 -42.26 94.53 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.803 0.841 . . . . 0.0 110.634 174.513 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 37.4 tp10 -60.68 -41.67 95.59 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.277 0.489 . . . . 0.0 111.254 170.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -66.16 -29.78 70.14 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-O 117.832 -1.08 . . . . 0.0 111.821 -178.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 95.0 mt -53.15 -40.48 64.33 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 119.485 1.039 . . . . 0.0 110.738 171.167 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 17.8 p -66.1 -49.62 66.91 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.451 0.7 . . . . 0.0 110.325 178.421 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 14.5 ttp180 -53.61 -48.03 69.66 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.889 0.876 . . . . 0.0 110.39 175.252 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -76.07 -0.12 20.73 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 125.438 1.495 . . . . 0.0 114.923 -178.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 34.1 m -104.41 -8.38 19.21 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 127.467 2.307 . . . . 0.0 114.179 171.146 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . 50.47 39.86 21.83 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 129.518 3.127 . . . . 0.0 111.889 -173.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 34.8 m -160.97 147.98 15.24 Favored 'General case' 0 C--O 1.232 0.137 0 C-N-CA 124.352 1.061 . . . . 0.0 108.604 171.137 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 73.5 mttt . . . . . 0 N--CA 1.453 -0.288 0 C-N-CA 125.151 1.381 . . . . 0.0 109.219 -171.466 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.5 tpt . . . . . 0 CA--C 1.539 0.541 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -74.13 67.95 5.04 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 124.022 3.148 . . . . 0.0 110.31 175.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -63.21 135.75 57.3 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.862 0.865 . . . . 0.0 110.264 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 56.2 mtmt -68.67 -10.62 57.31 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 170.383 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -145.01 95.65 5.13 Favored Pre-proline 0 C--N 1.321 -0.656 0 C-N-CA 128.259 2.624 . . . . 0.0 108.358 173.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_exo -54.97 -30.59 70.1 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 125.175 3.916 . . . . 0.0 113.639 -172.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 91.6 m -97.74 -11.87 22.93 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 125.83 1.652 . . . . 0.0 113.261 -169.026 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 23.1 tp60 -62.52 -26.83 68.76 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 118.194 0.452 . . . . 0.0 110.722 -178.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 51.5 tttm -58.4 -56.09 26.65 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 123.605 0.762 . . . . 0.0 110.497 169.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -62.73 -44.53 95.97 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.3 0.64 . . . . 0.0 109.667 -176.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -52.98 -38.76 62.49 Favored 'General case' 0 N--CA 1.462 0.171 0 C-N-CA 125.056 1.343 . . . . 0.0 113.218 173.012 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 66.4 m -60.03 -44.09 94.86 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 120.162 -0.615 . . . . 0.0 110.333 172.252 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -66.75 -27.59 67.73 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 117.324 -1.322 . . . . 0.0 113.196 -179.276 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.8 mp -55.88 -48.82 77.87 Favored 'Isoleucine or valine' 0 C--N 1.343 0.294 0 CA-C-N 121.037 1.744 . . . . 0.0 109.598 169.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -59.91 -55.98 27.41 Favored 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 24.3 mmtm -68.86 -31.56 70.61 Favored 'General case' 0 CA--C 1.522 -0.098 0 CA-C-O 118.527 -0.749 . . . . 0.0 112.004 -171.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 27.6 t -55.04 -47.01 75.34 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 169.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.54 -45.44 91.78 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-O 118.435 -0.793 . . . . 0.0 110.463 179.248 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -57.97 -46.56 84.95 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 119.261 0.937 . . . . 0.0 111.007 174.24 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.62 -14.86 59.86 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.044 0.937 . . . . 0.0 113.365 176.335 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 -120.8 8.34 10.55 Favored 'General case' 0 C--N 1.343 0.298 0 C-N-CA 124.334 1.054 . . . . 0.0 112.056 -174.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.5 m 57.56 40.75 26.64 Favored 'General case' 0 C--N 1.345 0.406 0 CA-C-O 122.511 1.148 . . . . 0.0 110.78 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.269 6.9 m-85 72.59 14.39 5.17 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 128.045 2.538 . . . . 0.0 114.48 168.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 69.5 mtm -70.08 82.39 0.5 Allowed 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 125.13 1.372 . . . . 0.0 109.941 169.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -52.97 -24.44 9.4 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.637 1.175 . . . . 0.0 111.164 169.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.0 m -51.4 -44.12 62.12 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 126.107 1.763 . . . . 0.0 112.201 169.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.3 mmtt -73.11 -47.77 41.44 Favored 'General case' 0 C--O 1.232 0.182 0 C-N-CA 124.634 1.174 . . . . 0.0 108.963 176.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.0 m -69.51 0.61 5.01 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 124.648 1.179 . . . . 0.0 113.073 -176.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 52.4 mm-40 -54.9 -30.27 57.91 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 119.887 1.221 . . . . 0.0 110.8 166.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.01 -54.79 43.12 Favored 'General case' 0 C--N 1.344 0.367 0 C-N-CA 124.702 1.201 . . . . 0.0 111.463 173.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.0 p -75.56 -31.02 22.63 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.727 0 C-N-CA 122.871 0.468 . . . . 0.0 110.405 -174.403 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.56 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 69.1 mt -59.03 -46.32 91.79 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 N-CA-C 106.345 -1.724 . . . . 0.0 106.345 168.649 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.71 -26.48 61.82 Favored 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 121.011 -1.056 . . . . 0.0 113.281 173.706 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -76.49 -37.76 56.32 Favored 'General case' 0 N--CA 1.432 -1.356 0 C-N-CA 119.846 -0.742 . . . . 0.0 110.277 175.16 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.497 ' HB3' ' CE2' ' A' ' 53' ' ' PHE . 2.8 mt -62.6 -32.37 73.36 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-O 117.778 -1.106 . . . . 0.0 109.514 169.5 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.5 mmt180 -62.79 -53.8 48.75 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 120.163 1.347 . . . . 0.0 108.195 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 54.6 mttp -64.2 -34.44 78.1 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.177 -178.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 47.5 t -63.25 -51.57 65.63 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 110.105 -0.332 . . . . 0.0 110.105 169.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 45.5 t -65.05 -47.77 76.2 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 124.673 1.189 . . . . 0.0 111.84 -169.065 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.93 -1.02 6.35 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 115.551 -0.75 . . . . 0.0 112.331 -175.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.563 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 12.0 tt0 -80.28 -11.66 59.7 Favored 'General case' 0 N--CA 1.443 -0.821 0 C-N-CA 125.94 1.696 . . . . 0.0 110.999 176.643 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.563 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 84.9 m-85 -136.42 158.03 74.21 Favored Pre-proline 0 N--CA 1.439 -0.99 0 C-N-CA 125.449 1.499 . . . . 0.0 111.243 -167.814 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -68.25 109.0 1.89 Allowed 'Trans proline' 0 N--CA 1.455 -0.771 0 N-CA-C 104.295 -3.002 . . . . 0.0 104.295 165.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.51 -36.49 0.39 Allowed 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 117.739 2.496 . . . . 0.0 117.739 -165.668 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.2 -14.72 12.42 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 124.55 1.071 . . . . 0.0 114.234 174.531 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 35.6 tpt85 -51.99 -33.2 37.12 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 126.986 2.114 . . . . 0.0 111.542 168.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.2 t -136.92 139.53 41.63 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-O 122.428 1.109 . . . . 0.0 110.625 -168.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 15.3 t -68.15 -54.08 24.71 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.695 0 CA-C-N 114.016 -1.447 . . . . 0.0 108.362 177.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 6.8 m -62.48 -42.42 95.67 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.119 -176.267 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 36.7 t -64.06 -32.37 73.89 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.634 1.574 . . . . 0.0 110.284 177.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.0 m -69.57 -26.04 64.28 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.83 -0.544 . . . . 0.0 111.131 171.348 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.91 -32.05 66.64 Favored Glycine 0 C--N 1.344 0.985 0 CA-C-O 123.427 1.571 . . . . 0.0 111.266 167.067 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.56 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 1.2 t80 -80.57 -43.23 20.97 Favored 'General case' 0 N--CA 1.417 -2.097 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 -164.206 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 25.6 mm-40 -67.51 -24.25 65.55 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 119.634 -0.826 . . . . 0.0 110.4 171.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 58.4 mttp -69.73 -37.76 76.63 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 120.998 -1.064 . . . . 0.0 109.49 166.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -62.17 -33.72 75.05 Favored 'General case' 0 C--O 1.22 -0.469 0 O-C-N 121.659 -0.651 . . . . 0.0 111.403 170.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 40.6 tp10 -63.27 -45.52 91.1 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 120.054 1.297 . . . . 0.0 109.403 174.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.54 -41.31 85.24 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 119.219 -0.42 . . . . 0.0 110.524 173.264 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -58.87 -50.82 72.57 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 118.627 0.649 . . . . 0.0 110.74 173.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -59.54 -37.75 79.24 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 123.464 0.706 . . . . 0.0 110.198 -178.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 55.6 mt -64.01 -26.97 68.81 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 118.236 -0.888 . . . . 0.0 112.175 176.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 29.0 p -65.25 -49.05 71.11 Favored 'General case' 0 C--N 1.344 0.342 0 CA-C-N 119.912 1.233 . . . . 0.0 110.047 169.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 13.0 mtm180 -65.16 -32.78 74.64 Favored 'General case' 0 C--N 1.339 0.11 0 C-N-CA 123.499 0.719 . . . . 0.0 111.322 -178.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? 40.66 40.94 1.02 Allowed 'General case' 0 C--N 1.344 0.361 0 C-N-CA 127.77 2.428 . . . . 0.0 111.785 -169.51 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.3 m -175.76 176.43 1.86 Allowed 'General case' 0 C--O 1.239 0.506 0 C-N-CA 127.799 2.44 . . . . 0.0 108.292 -177.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -63.91 153.68 36.2 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.017 0.927 . . . . 0.0 110.467 169.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 35.9 p -64.31 108.47 1.61 Allowed 'General case' 0 C--O 1.239 0.505 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 169.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 60.6 mtpt . . . . . 0 N--CA 1.464 0.236 0 C-N-CA 123.542 0.737 . . . . 0.0 110.426 174.119 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 mmt . . . . . 0 CA--C 1.538 0.51 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -56.54 156.11 23.45 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.711 2.274 . . . . 0.0 112.749 177.236 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 8.8 mp0 -69.16 17.9 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 127.722 2.409 . . . . 0.0 114.399 -172.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 55.6 tptt -141.41 136.26 31.19 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 126.263 1.825 . . . . 0.0 107.82 176.255 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -94.27 104.26 13.22 Favored Pre-proline 0 N--CA 1.447 -0.588 0 N-CA-C 105.941 -1.874 . . . . 0.0 105.941 169.033 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -54.7 -34.75 85.13 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 124.497 3.465 . . . . 0.0 112.664 -170.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.401 ' HB3' ' CD2' ' A' ' 35' ' ' LEU . 77.5 m -94.48 -13.77 25.82 Favored 'General case' 0 N--CA 1.433 -1.319 0 C-N-CA 125.54 1.536 . . . . 0.0 113.03 -169.313 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 26.2 tp60 -61.85 -25.28 67.43 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 118.754 0.707 . . . . 0.0 111.224 -179.136 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 51.8 tttm -59.53 -56.62 19.71 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.766 1.226 . . . . 0.0 110.166 169.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -63.61 -38.23 90.34 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.73 0.812 . . . . 0.0 110.203 -177.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.99 -42.17 72.14 Favored 'General case' 0 C--N 1.339 0.148 0 C-N-CA 124.901 1.28 . . . . 0.0 112.816 171.18 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 82.0 m -57.56 -46.48 83.89 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.29 172.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -62.99 -25.44 68.38 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 117.84 -1.076 . . . . 0.0 112.253 -178.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.408 HD13 HG13 ' A' ' 31' ' ' VAL . 34.6 mm -57.15 -54.47 29.98 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.378 0 CA-C-N 120.019 1.281 . . . . 0.0 109.235 172.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 36.7 mm-40 -58.18 -54.47 46.65 Favored 'General case' 0 N--CA 1.443 -0.816 0 O-C-N 124.18 0.925 . . . . 0.0 108.934 -178.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -66.5 -32.68 74.18 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 118.925 -1.11 . . . . 0.0 111.693 -175.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 25.2 t -56.2 -48.89 75.53 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 119.443 1.02 . . . . 0.0 108.902 169.397 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.73 -46.8 86.55 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 123.244 0.618 . . . . 0.0 110.487 179.826 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -57.11 -45.92 83.04 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.977 0.911 . . . . 0.0 111.199 174.35 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.54 -12.4 52.5 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.18 0.992 . . . . 0.0 113.424 175.3 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 52.2 m-80 -124.67 8.83 8.27 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.688 1.195 . . . . 0.0 112.187 -173.13 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.1 m 57.93 40.31 25.85 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.646 1.112 . . . . 0.0 110.979 179.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.265 6.9 m-85 72.17 14.05 5.66 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 127.817 2.447 . . . . 0.0 114.619 168.846 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 64.5 mtm -69.47 86.52 0.44 Allowed 'General case' 0 N--CA 1.44 -0.964 0 C-N-CA 125.127 1.371 . . . . 0.0 109.962 169.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -53.5 -26.12 19.42 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.252 1.021 . . . . 0.0 111.21 169.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.5 m -57.05 -32.13 65.89 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 127.497 2.319 . . . . 0.0 113.514 170.541 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.5 mmtm -79.62 -45.55 18.89 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.251 1.02 . . . . 0.0 108.769 171.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 81.2 m -73.88 9.0 1.67 Allowed 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 125.675 1.59 . . . . 0.0 113.709 -175.117 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.597 HE22 ' NH2' ' A' ' 63' ' ' ARG . 59.9 mm-40 -53.16 -38.14 62.48 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.425 -0.797 . . . . 0.0 110.737 168.049 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.31 -50.11 74.94 Favored 'General case' 0 C--N 1.342 0.242 0 C-N-CA 123.666 0.786 . . . . 0.0 111.631 178.21 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.408 HG13 HD13 ' A' ' 14' ' ' ILE . 8.7 p -75.13 -28.4 20.68 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.841 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.741 -175.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.482 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 55.4 mt -61.19 -50.14 81.72 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.637 0 N-CA-C 106.852 -1.536 . . . . 0.0 106.852 169.003 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -55.23 -27.81 48.83 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 123.819 0.848 . . . . 0.0 111.139 176.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -74.66 -43.29 56.02 Favored 'General case' 0 N--CA 1.441 -0.91 0 O-C-N 121.75 -0.594 . . . . 0.0 112.421 174.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.435 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 2.6 mt -62.14 -30.38 71.0 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 119.393 0.997 . . . . 0.0 110.547 170.417 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.9 ttt-85 -64.78 -58.88 5.04 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 126.433 1.893 . . . . 0.0 110.155 178.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.7 ptmt -65.94 -27.98 68.57 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.796 -179.489 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 47.7 t -65.76 -51.44 59.16 Favored 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 168.422 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.1 t -62.9 -48.78 77.49 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.435 0.694 . . . . 0.0 112.186 -169.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.48 -2.81 5.07 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 124.176 0.99 . . . . 0.0 112.608 -176.39 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.559 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 14.2 tt0 -79.26 -12.15 59.95 Favored 'General case' 0 N--CA 1.441 -0.883 0 C-N-CA 125.57 1.548 . . . . 0.0 111.032 175.677 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.559 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 83.9 m-85 -135.31 159.22 72.6 Favored Pre-proline 0 N--CA 1.442 -0.833 0 C-N-CA 125.032 1.333 . . . . 0.0 111.801 -167.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -69.19 115.14 3.87 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 N-CA-C 104.926 -2.759 . . . . 0.0 104.926 165.157 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.485 ' H ' ' HE2' ' A' ' 44' ' ' LYS . 0.3 OUTLIER -38.6 -44.39 0.97 Allowed 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 116.234 1.939 . . . . 0.0 116.234 -166.417 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -56.89 -12.36 6.87 Favored Glycine 0 CA--C 1.535 1.327 0 C-N-CA 124.842 1.21 . . . . 0.0 114.328 178.105 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 34.8 tpt85 -54.28 -34.24 60.4 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 127.01 2.124 . . . . 0.0 111.91 169.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.5 t -143.23 142.13 31.3 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 122.344 1.068 . . . . 0.0 111.055 -168.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 6.5 t -70.03 -56.39 11.45 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 CA-C-N 114.257 -1.338 . . . . 0.0 108.84 -179.01 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.2 m -60.23 -37.56 74.06 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 122.927 0.491 . . . . 0.0 110.581 -177.037 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . 0.452 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 8.1 t -69.37 -38.29 77.97 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.278 1.031 . . . . 0.0 109.919 177.663 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 44.5 m -65.04 -27.07 68.55 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.605 -0.685 . . . . 0.0 110.506 171.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.61 -25.61 75.42 Favored Glycine 0 C--N 1.343 0.959 0 CA-C-O 121.455 0.475 . . . . 0.0 112.5 169.66 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.482 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 0.3 OUTLIER -80.69 -46.42 15.58 Favored 'General case' 0 N--CA 1.431 -1.412 0 N-CA-C 115.449 1.648 . . . . 0.0 115.449 -165.489 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -64.19 -17.94 64.01 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.925 173.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 10.5 mmpt? -81.71 -44.09 17.56 Favored 'General case' 0 C--N 1.348 0.52 0 C-N-CA 123.952 0.901 . . . . 0.0 110.595 165.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -56.76 -26.77 58.2 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.399 1.079 . . . . 0.0 111.549 173.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.7 -40.34 75.44 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.678 1.191 . . . . 0.0 109.657 173.497 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -66.41 -40.11 89.37 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.818 0.847 . . . . 0.0 109.883 176.524 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -53.9 -51.28 64.24 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 122.855 0.462 . . . . 0.0 110.659 169.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -63.13 -37.42 87.14 Favored 'General case' 0 C--N 1.327 -0.379 0 O-C-N 121.823 -0.548 . . . . 0.0 111.093 -175.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.9 tp -67.99 -43.67 78.39 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 126.331 1.852 . . . . 0.0 109.046 179.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -68.64 -31.26 70.28 Favored 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.902 -0.499 . . . . 0.0 110.963 176.236 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.597 ' NH2' HE22 ' A' ' 29' ' ' GLN . 15.4 ttm105 -76.02 -39.66 55.21 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 -176.107 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -66.55 178.74 1.18 Allowed 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 122.091 0.948 . . . . 0.0 113.331 -171.035 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 7.9 m -56.96 162.02 2.67 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.953 1.301 . . . . 0.0 111.437 174.161 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . 58.7 25.53 13.48 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.987 1.315 . . . . 0.0 112.902 -169.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 45.0 t -147.82 -179.65 7.05 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 128.424 2.689 . . . . 0.0 106.418 169.437 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 98.9 mttt . . . . . 0 N--CA 1.468 0.434 0 C-N-CA 127.383 2.273 . . . . 0.0 111.92 -178.965 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.9 mmt . . . . . 0 CA--C 1.538 0.49 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -71.35 135.14 26.1 Favored 'Trans proline' 0 N--CA 1.455 -0.769 0 C-N-CA 122.628 2.218 . . . . 0.0 110.185 170.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 11.4 mp0 -65.97 -26.77 67.71 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 126.6 1.96 . . . . 0.0 113.166 -168.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.7 ttpt -62.47 109.92 1.52 Allowed 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 107.663 -1.236 . . . . 0.0 107.663 171.353 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 18.1 t0 -93.96 103.29 9.99 Favored Pre-proline 0 N--CA 1.448 -0.551 0 C-N-CA 125.526 1.53 . . . . 0.0 108.185 -171.228 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -56.84 -34.48 96.86 Favored 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 123.979 3.119 . . . . 0.0 112.699 -170.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 69.2 m -94.24 -13.06 26.97 Favored 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 125.134 1.374 . . . . 0.0 112.914 -169.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 33.3 tp60 -62.72 -25.81 68.36 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 118.614 0.643 . . . . 0.0 110.827 179.206 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 50.7 tptt -60.11 -54.49 45.3 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 123.336 0.654 . . . . 0.0 110.21 169.238 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -62.98 -38.99 93.38 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.382 0.673 . . . . 0.0 109.907 -177.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -55.35 -45.02 76.48 Favored 'General case' 0 CA--C 1.518 -0.288 0 C-N-CA 124.954 1.302 . . . . 0.0 112.406 169.585 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 62.6 m -59.09 -40.34 85.0 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 118.119 0.418 . . . . 0.0 111.337 173.208 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -65.4 -21.52 66.68 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-O 117.776 -1.107 . . . . 0.0 112.679 176.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.431 HD13 HG13 ' A' ' 31' ' ' VAL . 28.0 mm -60.26 -50.37 80.51 Favored 'Isoleucine or valine' 0 C--N 1.342 0.28 0 CA-C-N 120.532 1.514 . . . . 0.0 109.388 171.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -58.75 -57.08 14.58 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 107.409 -1.33 . . . . 0.0 107.409 179.618 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 42.0 mtpt -68.35 -29.43 68.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 118.597 -0.716 . . . . 0.0 111.701 -169.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.402 ' CB ' HG11 ' A' ' 31' ' ' VAL . 25.7 t -56.15 -47.56 77.96 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 118.889 0.768 . . . . 0.0 109.186 169.024 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.41 -44.86 89.22 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 118.662 -0.685 . . . . 0.0 111.086 178.748 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.471 ' HA ' ' CE1' ' A' ' 23' ' ' TYR . 3.0 mp0 -58.37 -43.49 88.48 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 118.214 0.461 . . . . 0.0 111.428 173.665 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.99 -12.44 61.61 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 114.189 1.181 . . . . 0.0 114.189 176.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -125.87 15.01 8.02 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 119.673 1.124 . . . . 0.0 113.789 -168.817 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 18.1 m 60.56 35.1 20.16 Favored 'General case' 0 C--N 1.346 0.414 0 CA-C-N 120.619 1.554 . . . . 0.0 110.067 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.471 ' CE1' ' HA ' ' A' ' 19' ' ' GLN . 38.0 m-85 68.18 14.83 9.33 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 126.588 1.955 . . . . 0.0 113.737 167.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 62.9 mtm -74.54 89.72 2.2 Favored 'General case' 0 N--CA 1.439 -1.021 0 C-N-CA 126.048 1.739 . . . . 0.0 108.903 175.553 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -55.42 -23.77 26.74 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 119.165 -0.445 . . . . 0.0 111.405 172.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.4 m -52.33 -44.69 65.3 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 126.424 1.89 . . . . 0.0 112.098 170.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 62.8 mmtt -67.32 -47.65 69.9 Favored 'General case' 0 C--N 1.341 0.205 0 C-N-CA 123.832 0.853 . . . . 0.0 108.959 174.044 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.425 ' O ' HG12 ' A' ' 31' ' ' VAL . 71.8 m -71.31 0.61 7.66 Favored 'General case' 0 N--CA 1.443 -0.791 0 C-N-CA 124.455 1.102 . . . . 0.0 112.945 -174.181 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 -56.59 -25.71 53.48 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 120.042 1.292 . . . . 0.0 111.101 167.186 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.06 -49.43 76.94 Favored 'General case' 0 C--N 1.345 0.381 0 C-N-CA 125.648 1.579 . . . . 0.0 112.174 169.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.431 HG13 HD13 ' A' ' 14' ' ' ILE . 7.4 p -82.67 -26.5 8.45 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.877 0 C-N-CA 123.917 0.887 . . . . 0.0 109.88 -174.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.5 mp -59.39 -47.06 91.95 Favored 'Isoleucine or valine' 0 C--N 1.348 0.541 0 N-CA-C 105.476 -2.046 . . . . 0.0 105.476 165.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.14 -32.53 62.16 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 123.12 0.568 . . . . 0.0 112.002 175.372 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -74.92 -39.88 61.17 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 119.951 -0.7 . . . . 0.0 111.463 178.361 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.496 HD13 ' CE1' ' A' ' 53' ' ' PHE . 1.6 mt -63.6 -35.48 80.65 Favored 'General case' 0 C--N 1.342 0.248 0 CA-C-N 119.217 0.917 . . . . 0.0 110.097 173.57 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.07 -60.46 3.46 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 125.104 1.361 . . . . 0.0 109.592 174.357 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -59.95 -38.54 82.77 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 113.728 -1.578 . . . . 0.0 110.235 -176.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 52.3 t -60.44 -52.06 66.84 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 122.937 0.495 . . . . 0.0 109.678 171.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 38.1 t -60.15 -43.36 95.82 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 121.09 0.472 . . . . 0.0 111.323 -172.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.04 -2.03 6.95 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 125.383 1.473 . . . . 0.0 113.378 179.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.556 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 23.3 tt0 -80.46 -8.81 59.69 Favored 'General case' 0 N--CA 1.442 -0.84 0 C-N-CA 123.882 0.873 . . . . 0.0 110.523 171.809 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.556 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 84.6 m-85 -141.07 167.12 18.37 Favored Pre-proline 0 N--CA 1.444 -0.765 0 C-N-CA 125.659 1.584 . . . . 0.0 111.458 -167.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -66.24 139.42 55.03 Favored 'Trans proline' 0 CA--C 1.538 0.698 0 N-CA-C 106.633 -2.103 . . . . 0.0 106.633 164.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.9 ptpp? -57.92 -26.69 62.55 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 115.115 1.524 . . . . 0.0 115.115 -168.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -80.69 0.62 85.66 Favored Glycine 0 CA--C 1.531 1.07 0 C-N-CA 124.24 0.924 . . . . 0.0 113.817 177.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 46.0 tpt85 -58.13 -35.97 72.27 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-N 119.368 1.584 . . . . 0.0 112.623 179.217 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -141.14 151.36 43.83 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 124.832 1.253 . . . . 0.0 110.038 -166.258 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 8.8 t -69.02 -56.68 11.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 123.938 0.895 . . . . 0.0 109.259 -177.37 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 9.2 m -59.73 -38.96 78.34 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 C-N-CA 122.954 0.502 . . . . 0.0 109.982 -179.09 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . 0.477 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 11.2 t -68.39 -35.37 77.59 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.349 1.06 . . . . 0.0 109.837 179.374 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 48.9 m -64.36 -28.15 69.5 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 121.744 -0.598 . . . . 0.0 110.592 172.491 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -74.38 -25.14 71.28 Favored Glycine 0 C--N 1.344 1.012 0 CA-C-O 121.981 0.767 . . . . 0.0 111.809 172.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.496 ' CE1' HD13 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -81.9 -50.25 9.39 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.944 1.698 . . . . 0.0 114.447 -167.805 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -64.84 -22.23 66.95 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 115.591 -0.732 . . . . 0.0 110.434 174.18 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 63.6 tttm -70.68 -40.75 72.75 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 118.971 0.805 . . . . 0.0 110.445 167.086 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -56.09 -51.56 67.45 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 118.924 0.784 . . . . 0.0 109.719 170.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -63.76 -39.28 93.89 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.631 1.172 . . . . 0.0 110.95 -177.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -59.34 -47.05 86.86 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.74 0.816 . . . . 0.0 110.194 171.245 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -55.5 -47.13 76.68 Favored 'General case' 0 C--O 1.223 -0.294 0 CA-C-N 117.936 0.335 . . . . 0.0 110.349 173.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -62.51 -53.08 60.09 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 118.086 0.403 . . . . 0.0 110.754 -177.597 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.6 pp -67.19 -36.01 80.85 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 118.906 -0.569 . . . . 0.0 110.891 -173.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.11 -32.82 65.2 Favored 'General case' 0 C--N 1.341 0.239 0 CA-C-N 118.577 0.626 . . . . 0.0 111.299 176.318 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 25.0 ttm180 -75.9 -18.29 59.45 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 122.749 0.419 . . . . 0.0 111.814 174.573 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 21.3 tptp 57.35 37.19 27.93 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 128.03 2.532 . . . . 0.0 110.419 -175.03 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 23.0 t -157.24 -178.94 7.73 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 125.077 1.351 . . . . 0.0 109.034 -178.375 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -102.86 15.52 29.13 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.248 1.819 . . . . 0.0 111.727 168.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 29.3 m -70.56 39.23 0.05 Allowed 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 129.058 2.943 . . . . 0.0 112.359 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 12.2 ptpt . . . . . 0 CA--C 1.529 0.153 0 C-N-CA 126.41 1.884 . . . . 0.0 111.754 -178.659 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.4 ptm . . . . . 0 N--CA 1.443 -0.785 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -68.67 160.63 48.66 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 122.015 1.81 . . . . 0.0 110.095 169.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 20.8 mp0 -74.43 58.38 0.75 Allowed 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.465 1.906 . . . . 0.0 111.443 -175.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.41 ' HG3' ' H ' ' A' ' 5' ' ' ASP . 22.5 tptp 58.05 -177.08 0.07 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 126.821 2.048 . . . . 0.0 111.346 -173.811 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.41 ' H ' ' HG3' ' A' ' 4' ' ' LYS . 12.6 t0 -145.26 112.38 4.74 Favored Pre-proline 0 N--CA 1.448 -0.572 0 C-N-CA 129.678 3.191 . . . . 0.0 102.92 177.807 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -66.79 -35.88 26.03 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 123.555 2.837 . . . . 0.0 112.219 -169.494 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 87.5 m -94.77 -13.65 25.45 Favored 'General case' 0 N--CA 1.436 -1.155 0 C-N-CA 124.006 0.922 . . . . 0.0 113.45 -167.349 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.472 ' HA ' HG11 ' A' ' 49' ' ' VAL . 1.9 tm0? -51.21 -37.49 47.05 Favored 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 125.289 1.436 . . . . 0.0 111.489 171.899 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -57.23 -58.76 6.8 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 125.323 1.449 . . . . 0.0 110.039 171.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -62.39 -36.93 83.85 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.271 0.628 . . . . 0.0 110.774 -176.329 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -57.95 -38.91 76.84 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.617 1.167 . . . . 0.0 112.172 172.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 75.5 m -61.36 -43.06 99.51 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 118.399 0.545 . . . . 0.0 110.718 172.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -63.79 -22.33 66.86 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 117.95 -1.024 . . . . 0.0 112.328 178.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 23.9 mm -60.51 -53.7 45.28 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.334 0 CA-C-N 120.291 1.405 . . . . 0.0 109.277 171.571 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 16.8 mm-40 -61.35 -52.34 65.05 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 -178.239 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 40.7 mtpt -68.13 -30.75 69.97 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 118.29 -0.862 . . . . 0.0 111.354 -174.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 14.1 t -58.01 -47.94 81.53 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-N 119.298 0.954 . . . . 0.0 108.444 168.36 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.7 -47.02 83.55 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.287 0.635 . . . . 0.0 110.384 179.068 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -57.46 -44.9 85.19 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.918 0.887 . . . . 0.0 111.193 174.119 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.58 -12.76 59.37 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 175.016 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 47.9 m-80 -124.37 8.63 8.44 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 124.584 1.154 . . . . 0.0 112.308 -172.46 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 58.61 40.11 23.92 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 122.367 1.08 . . . . 0.0 110.915 179.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.258 7.1 m-85 71.98 13.98 5.87 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 127.883 2.473 . . . . 0.0 114.619 168.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 68.3 mtm -70.63 83.93 0.62 Allowed 'General case' 0 N--CA 1.443 -0.821 0 C-N-CA 125.128 1.371 . . . . 0.0 109.695 170.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -54.4 -23.26 15.03 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.687 0.795 . . . . 0.0 111.722 172.283 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.6 m -53.03 -40.87 64.21 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 126.013 1.725 . . . . 0.0 112.273 170.047 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 50.6 mmtt -70.81 -47.69 58.13 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 124.31 1.044 . . . . 0.0 108.809 174.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.6 m -73.12 1.37 9.25 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 124.711 1.205 . . . . 0.0 113.267 -173.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 76.0 mm-40 -54.41 -31.08 54.31 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 119.485 1.039 . . . . 0.0 110.488 167.242 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.69 -58.23 8.69 Favored 'General case' 0 C--N 1.345 0.39 0 C-N-CA 124.884 1.274 . . . . 0.0 111.463 174.096 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.8 p -74.6 -28.99 22.77 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.91 0 C-N-CA 123.981 0.913 . . . . 0.0 109.995 -173.243 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.469 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 58.1 mt -59.52 -48.99 85.29 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 N-CA-C 105.943 -1.873 . . . . 0.0 105.943 168.043 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.5 ' HA ' ' HG3' ' A' ' 36' ' ' ARG . 0.7 OUTLIER -61.1 -31.6 71.28 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 119.325 0.966 . . . . 0.0 113.097 175.572 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -68.49 -39.92 81.14 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 119.433 1.015 . . . . 0.0 110.089 175.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.52 HD13 ' CE1' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -63.33 -29.05 70.43 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 124.648 1.179 . . . . 0.0 108.774 176.037 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.5 ' HG3' ' HA ' ' A' ' 33' ' ' GLN . 10.3 mmt85 -69.68 -50.44 43.85 Favored 'General case' 0 CA--C 1.512 -0.505 0 CA-C-N 119.203 0.91 . . . . 0.0 108.556 -179.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 62.9 mmtt -63.07 -32.84 74.3 Favored 'General case' 0 C--O 1.235 0.296 0 O-C-N 123.849 0.718 . . . . 0.0 111.069 178.735 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.2 t -62.5 -54.59 37.71 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 169.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 46.5 t -62.88 -47.95 81.11 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 124.058 0.943 . . . . 0.0 111.936 -169.694 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.26 -0.95 5.28 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 124.59 1.156 . . . . 0.0 112.609 -177.467 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.51 ' HB3' ' CE2' ' A' ' 42' ' ' TYR . 2.1 tp-100 -79.13 -11.69 59.98 Favored 'General case' 0 N--CA 1.438 -1.073 0 C-N-CA 123.767 0.827 . . . . 0.0 111.463 172.106 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.51 ' CE2' ' HB3' ' A' ' 41' ' ' GLN . 68.0 m-85 -137.27 156.66 75.21 Favored Pre-proline 0 N--CA 1.443 -0.812 0 C-N-CA 123.972 0.909 . . . . 0.0 112.151 -167.146 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.8 121.5 8.56 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 N-CA-C 105.645 -2.483 . . . . 0.0 105.645 166.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -44.5 -40.52 5.67 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 116.306 1.965 . . . . 0.0 116.306 -166.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.44 -13.78 31.61 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 123.783 0.706 . . . . 0.0 113.657 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.06 -21.19 66.0 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.859 1.263 . . . . 0.0 112.449 171.093 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.8 t -142.84 137.03 29.33 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-O 122.988 1.375 . . . . 0.0 111.107 -176.44 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 19.3 t -66.98 -53.45 33.93 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.615 0 CA-C-N 113.852 -1.522 . . . . 0.0 108.926 -178.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.472 HG11 ' HA ' ' A' ' 8' ' ' GLN . 2.4 m -59.81 -46.65 93.45 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 -178.761 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 42.2 t -63.0 -30.65 71.77 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.952 1.301 . . . . 0.0 109.924 -176.678 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 64.5 m -68.0 -24.81 65.17 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 118.663 -0.684 . . . . 0.0 111.893 174.073 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -74.08 -40.22 43.31 Favored Glycine 0 N--CA 1.471 1.001 0 CA-C-O 124.288 2.049 . . . . 0.0 111.193 167.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.52 ' CE1' HD13 ' A' ' 35' ' ' LEU . 2.0 t80 -76.63 -37.67 55.97 Favored 'General case' 0 N--CA 1.411 -2.395 0 CA-C-N 111.055 -2.573 . . . . 0.0 116.848 -162.545 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -63.39 -26.08 68.58 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 119.651 -0.82 . . . . 0.0 110.766 169.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.2 mtmp? -70.49 -41.16 73.04 Favored 'General case' 0 C--N 1.348 0.523 0 CA-C-N 119.657 1.117 . . . . 0.0 110.403 170.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -56.18 -48.91 75.43 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.23 1.012 . . . . 0.0 109.816 173.127 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -62.53 -46.72 87.09 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 125.646 1.578 . . . . 0.0 110.488 -179.274 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -59.17 -41.74 89.13 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 122.67 0.388 . . . . 0.0 110.755 173.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -60.49 -43.52 96.93 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 118.368 0.531 . . . . 0.0 110.942 173.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -64.79 -33.48 76.09 Favored 'General case' 0 C--N 1.329 -0.285 0 O-C-N 121.07 -1.019 . . . . 0.0 111.2 179.4 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 47.6 mt -72.64 -40.17 66.6 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 123.961 0.904 . . . . 0.0 109.527 178.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -63.62 -38.68 92.05 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 118.818 -0.61 . . . . 0.0 110.735 172.43 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 76.7 mmt-85 -62.04 -50.54 71.59 Favored 'General case' 0 C--N 1.347 0.489 0 CA-C-N 119.338 0.972 . . . . 0.0 110.291 172.502 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.435 ' HA ' ' HE3' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -75.95 59.83 1.31 Allowed 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.773 1.229 . . . . 0.0 110.511 177.863 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 59.8 p -137.29 177.12 8.11 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.519 1.528 . . . . 0.0 110.037 177.299 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -141.71 22.54 2.13 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.592 1.157 . . . . 0.0 111.76 171.113 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 28.6 m -175.55 169.09 3.15 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 128.232 2.613 . . . . 0.0 107.758 178.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp . . . . . 0 CA--C 1.529 0.164 0 C-N-CA 123.302 0.641 . . . . 0.0 109.555 174.704 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.1 mtt . . . . . 0 CA--C 1.544 0.738 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -55.48 112.43 1.05 Allowed 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 123.394 2.73 . . . . 0.0 111.35 -177.202 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 16.8 mp0 -55.33 -30.64 60.65 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.657 1.183 . . . . 0.0 113.395 -168.008 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.6 mmmt -104.2 0.87 29.96 Favored 'General case' 0 CA--C 1.515 -0.366 0 N-CA-C 115.424 1.638 . . . . 0.0 115.424 178.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -145.55 82.9 9.27 Favored Pre-proline 0 C--N 1.323 -0.564 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 168.574 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -51.62 -36.37 60.49 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 124.48 3.453 . . . . 0.0 112.37 -169.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 95.4 m -92.97 -8.73 42.25 Favored 'General case' 0 N--CA 1.436 -1.156 0 C-N-CA 126.538 1.935 . . . . 0.0 113.279 -169.152 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 29.4 tp60 -62.89 -24.97 68.08 Favored 'General case' 0 N--CA 1.446 -0.655 0 O-C-N 121.596 -0.69 . . . . 0.0 110.659 178.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -57.63 -56.78 17.52 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 123.424 0.689 . . . . 0.0 109.594 168.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 20.2 mp0 -59.06 -43.39 91.71 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 123.646 0.778 . . . . 0.0 110.203 -177.654 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.23 -44.11 71.44 Favored 'General case' 0 C--N 1.339 0.133 0 C-N-CA 124.404 1.081 . . . . 0.0 112.209 174.052 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 97.4 m -60.55 -45.64 93.14 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 117.498 0.135 . . . . 0.0 110.915 172.101 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 61.0 mm-40 -63.16 -23.65 67.53 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 117.577 -1.202 . . . . 0.0 112.745 178.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 43.7 mm -57.05 -54.16 33.76 Favored 'Isoleucine or valine' 0 C--N 1.342 0.254 0 CA-C-N 120.659 1.572 . . . . 0.0 109.233 172.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 34.7 mm-40 -58.75 -54.01 51.88 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 124.02 0.825 . . . . 0.0 109.086 -179.205 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.2 mptp? -66.81 -32.21 73.35 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 118.944 -1.102 . . . . 0.0 111.709 -174.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 24.7 t -56.42 -48.35 77.15 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 119.381 0.991 . . . . 0.0 108.841 169.029 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.32 -46.8 85.49 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 123.216 0.606 . . . . 0.0 110.628 179.297 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -56.97 -45.58 82.78 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.739 0.816 . . . . 0.0 111.205 174.021 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.95 -12.57 55.83 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.027 0.931 . . . . 0.0 113.437 175.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.7 m-80 -124.31 8.68 8.48 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.617 1.167 . . . . 0.0 112.228 -173.164 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 58.32 40.19 24.75 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 122.426 1.108 . . . . 0.0 110.913 179.619 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.255 6.9 m-85 71.98 13.64 5.92 Favored 'General case' 0 N--CA 1.445 -0.701 0 C-N-CA 127.817 2.447 . . . . 0.0 114.619 168.865 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 67.2 mtm -71.01 83.72 0.69 Allowed 'General case' 0 N--CA 1.44 -0.942 0 C-N-CA 125.144 1.378 . . . . 0.0 109.474 170.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -55.89 -22.11 23.9 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.949 0.9 . . . . 0.0 111.973 173.602 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 7.0 m -56.99 -34.18 67.87 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 126.728 2.011 . . . . 0.0 113.086 169.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 52.4 mmtt -74.89 -46.2 37.66 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 124.052 0.941 . . . . 0.0 108.74 171.813 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.3 m -73.73 6.13 3.45 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 125.133 1.373 . . . . 0.0 113.191 -174.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.584 HE22 ' NH2' ' A' ' 63' ' ' ARG . 40.0 mm-40 -54.93 -31.87 60.72 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 119.182 0.901 . . . . 0.0 110.139 167.138 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.33 -56.86 16.41 Favored 'General case' 0 C--N 1.345 0.391 0 C-N-CA 125.117 1.367 . . . . 0.0 111.433 174.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.7 p -73.69 -27.71 23.45 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 C-N-CA 123.843 0.857 . . . . 0.0 110.083 -174.308 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.546 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 63.6 mt -61.03 -49.53 84.34 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 N-CA-C 106.605 -1.628 . . . . 0.0 106.605 168.135 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -55.98 -30.84 62.37 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 118.915 0.78 . . . . 0.0 111.849 174.318 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -69.14 -46.19 68.24 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 118.862 0.756 . . . . 0.0 111.632 173.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.494 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.5 mt -55.74 -34.03 64.81 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-N 119.005 0.821 . . . . 0.0 109.577 172.384 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -70.39 -54.72 11.3 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 125.086 1.355 . . . . 0.0 111.648 -176.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 62.3 mttm -61.45 -34.7 75.88 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 124.728 1.211 . . . . 0.0 110.779 176.425 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 50.8 t -63.82 -51.01 66.65 Favored 'General case' 0 N--CA 1.444 -0.77 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 169.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 53.9 t -61.77 -50.07 73.82 Favored 'General case' 0 CA--C 1.515 -0.379 0 C-N-CA 123.446 0.698 . . . . 0.0 112.084 -172.029 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.51 -1.8 5.53 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 124.629 1.172 . . . . 0.0 111.98 -176.139 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.48 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 2.3 tp-100 -79.64 -8.12 58.99 Favored 'General case' 0 N--CA 1.438 -1.042 0 C-N-CA 124.589 1.156 . . . . 0.0 111.123 174.2 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.48 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 79.2 m-85 -141.6 163.1 43.23 Favored Pre-proline 0 N--CA 1.441 -0.913 0 C-N-CA 125.446 1.498 . . . . 0.0 111.024 -168.264 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -67.81 135.46 35.54 Favored 'Trans proline' 0 CA--C 1.537 0.638 0 N-CA-C 106.35 -2.212 . . . . 0.0 106.35 165.658 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -55.1 -29.47 57.7 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 114.889 1.44 . . . . 0.0 114.889 -168.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -67.86 -9.17 55.78 Favored Glycine 0 CA--C 1.533 1.201 0 CA-C-O 119.062 -0.855 . . . . 0.0 113.922 177.278 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 41.4 tpt85 -60.89 -31.97 71.44 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 119.171 1.486 . . . . 0.0 112.221 175.207 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.4 t -144.79 138.19 26.94 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 123.538 0.735 . . . . 0.0 110.273 -168.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 11.0 t -63.59 -56.75 15.15 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 CA-C-N 114.748 -1.115 . . . . 0.0 108.743 -178.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.2 m -59.01 -40.7 81.28 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 123.571 0.748 . . . . 0.0 110.438 -176.281 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . 0.412 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 6.9 t -66.64 -37.84 85.67 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.82 1.248 . . . . 0.0 109.648 179.016 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 27.1 p -65.56 -25.07 67.26 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 121.788 -0.57 . . . . 0.0 111.051 174.207 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.89 -26.77 68.26 Favored Glycine 0 C--N 1.346 1.095 0 CA-C-O 121.759 0.644 . . . . 0.0 112.423 170.049 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.546 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 0.4 OUTLIER -80.43 -46.51 15.84 Favored 'General case' 0 N--CA 1.429 -1.523 0 N-CA-C 116.043 1.868 . . . . 0.0 116.043 -164.641 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 71.2 mt-10 -61.86 -21.72 64.91 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.54 172.291 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -81.01 -44.33 18.25 Favored 'General case' 0 C--N 1.347 0.495 0 CA-C-N 119.242 0.928 . . . . 0.0 110.926 167.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -56.37 -26.29 52.44 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.025 0.93 . . . . 0.0 111.224 174.635 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -54.38 -44.69 72.48 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 124.557 1.143 . . . . 0.0 109.908 174.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -69.59 -32.6 71.44 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.927 0.891 . . . . 0.0 110.669 178.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -61.89 -45.14 95.06 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 117.816 0.28 . . . . 0.0 110.546 169.12 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -67.47 -27.47 67.05 Favored 'General case' 0 C--O 1.226 -0.143 0 C-N-CA 123.755 0.822 . . . . 0.0 111.757 -176.136 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 91.2 mt -52.44 -23.3 5.86 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 118.53 -0.747 . . . . 0.0 112.87 171.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 72.9 p -58.89 -64.67 0.85 Allowed 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 119.505 1.048 . . . . 0.0 109.638 169.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.584 ' NH2' HE22 ' A' ' 29' ' ' GLN . 61.2 mtm-85 -56.83 -45.15 82.53 Favored 'General case' 0 C--O 1.228 -0.027 0 C-N-CA 125.095 1.358 . . . . 0.0 111.095 177.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 23.2 mmtp -81.58 53.62 2.16 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.103 1.361 . . . . 0.0 110.064 -176.291 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 77.4 p -138.12 173.79 11.25 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 125.204 1.402 . . . . 0.0 111.828 178.139 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.35 132.8 55.06 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.422 1.089 . . . . 0.0 110.623 -176.391 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 95.5 p 60.19 17.04 6.55 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 125.713 1.605 . . . . 0.0 114.979 -174.589 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 29.3 mtpp . . . . . 0 N--CA 1.45 -0.444 0 C-N-CA 126.332 1.853 . . . . 0.0 108.041 173.32 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 90.3 mmm . . . . . 0 CA--C 1.537 0.465 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -62.96 123.77 12.82 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 122.683 2.255 . . . . 0.0 109.36 173.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 90.7 mm-40 -77.67 57.82 1.7 Allowed 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 125.559 1.543 . . . . 0.0 111.672 -170.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -63.19 146.52 53.18 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.986 0.914 . . . . 0.0 110.122 178.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -93.97 99.52 3.74 Favored Pre-proline 0 N--CA 1.446 -0.667 0 N-CA-C 106.288 -1.745 . . . . 0.0 106.288 169.158 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -60.18 -37.23 84.9 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 123.211 2.607 . . . . 0.0 111.964 -171.229 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 93.5 m -92.01 -9.51 42.61 Favored 'General case' 0 N--CA 1.443 -0.791 0 C-N-CA 125.189 1.396 . . . . 0.0 113.047 -167.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 20.1 tp60 -59.53 -25.51 64.57 Favored 'General case' 0 N--CA 1.439 -0.993 0 CA-C-O 118.99 -0.529 . . . . 0.0 110.063 172.087 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 56.5 tptt -56.35 -61.68 2.24 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.895 1.278 . . . . 0.0 109.122 167.439 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 19.5 mp0 -57.91 -42.34 84.54 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 118.826 -0.607 . . . . 0.0 110.36 -177.431 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -56.56 -40.52 75.32 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.495 1.118 . . . . 0.0 112.388 174.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 96.6 m -64.63 -45.01 88.67 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 123.338 0.655 . . . . 0.0 111.27 170.234 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -63.76 -26.33 68.59 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-O 117.434 -1.269 . . . . 0.0 111.958 -179.299 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.601 HD13 HG22 ' A' ' 31' ' ' VAL . 12.1 mm -57.06 -50.11 77.42 Favored 'Isoleucine or valine' 0 C--N 1.34 0.192 0 CA-C-N 120.439 1.472 . . . . 0.0 109.036 170.311 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 47.2 mm-40 -60.18 -49.54 77.24 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 -174.127 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 26.8 mttp -71.71 -37.51 70.64 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 124.272 1.029 . . . . 0.0 111.943 -176.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 11.3 t -53.23 -43.34 67.21 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 108.463 -0.939 . . . . 0.0 108.463 169.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.01 -45.61 90.26 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 -178.075 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.414 ' HA ' ' CE1' ' A' ' 23' ' ' TYR . 5.1 mm-40 -64.57 -41.78 96.06 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 123.852 0.861 . . . . 0.0 110.521 179.11 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.22 -11.93 17.44 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.172 0.804 . . . . 0.0 113.172 171.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 55.4 m-80 -126.32 9.65 7.3 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.067 1.347 . . . . 0.0 112.257 -175.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 12.6 m 54.48 42.01 31.61 Favored 'General case' 0 C--N 1.345 0.389 0 CA-C-O 122.68 1.229 . . . . 0.0 111.983 -178.16 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.414 ' CE1' ' HA ' ' A' ' 19' ' ' GLN 0.264 7.3 m-85 73.36 13.45 4.61 Favored 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 128.523 2.729 . . . . 0.0 114.526 168.046 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 66.7 mtm -69.6 85.02 0.44 Allowed 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 125.121 1.368 . . . . 0.0 109.761 169.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -54.46 -23.65 16.99 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.376 0.671 . . . . 0.0 111.538 171.09 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.1 m -52.73 -41.29 63.84 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 126.161 1.784 . . . . 0.0 112.151 170.082 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.3 mmtm -71.85 -47.8 50.54 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.28 1.032 . . . . 0.0 108.926 175.034 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.3 m -70.95 1.0 6.16 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 124.679 1.191 . . . . 0.0 112.919 -175.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 74.0 mm-40 -55.45 -29.53 58.84 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 119.635 1.107 . . . . 0.0 110.131 166.37 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.29 -59.25 5.21 Favored 'General case' 0 C--N 1.345 0.378 0 C-N-CA 124.946 1.298 . . . . 0.0 111.371 173.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.601 HG22 HD13 ' A' ' 14' ' ' ILE . 14.9 p -72.46 -29.15 30.18 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.819 0 C-N-CA 124.057 0.943 . . . . 0.0 109.909 -174.418 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 60.9 mt -60.69 -48.53 88.32 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 N-CA-C 106.263 -1.754 . . . . 0.0 106.263 169.077 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.407 ' HA ' ' HG3' ' A' ' 36' ' ' ARG . 0.9 OUTLIER -61.6 -28.99 69.75 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 119.637 1.108 . . . . 0.0 113.224 174.192 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 46.4 tt0 -67.11 -39.18 86.65 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 119.419 1.009 . . . . 0.0 109.973 172.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.532 HD13 ' CE1' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -60.07 -30.48 69.25 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 125.726 1.61 . . . . 0.0 109.084 175.294 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.407 ' HG3' ' HA ' ' A' ' 33' ' ' GLN . 18.9 mmt85 -71.89 -50.94 24.91 Favored 'General case' 0 C--N 1.343 0.292 0 C-N-CA 123.982 0.913 . . . . 0.0 108.567 -179.427 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -63.51 -29.78 71.0 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 124.755 1.222 . . . . 0.0 111.224 178.358 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 51.7 t -67.96 -55.44 12.73 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 167.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 44.3 t -59.61 -44.32 93.45 Favored 'General case' 0 C--N 1.328 -0.336 0 O-C-N 121.107 -0.995 . . . . 0.0 112.904 -170.253 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.25 -0.67 10.45 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 113.216 0.821 . . . . 0.0 113.216 -174.355 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.557 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 13.2 tt0 -93.62 -9.31 38.41 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 126.891 2.076 . . . . 0.0 111.914 -169.695 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.557 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 81.2 m-85 -133.84 163.08 53.72 Favored Pre-proline 0 N--CA 1.448 -0.537 0 C-N-CA 124.681 1.193 . . . . 0.0 111.625 -167.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -68.84 94.26 0.45 Allowed 'Trans proline' 0 N--CA 1.456 -0.723 0 N-CA-C 104.743 -2.83 . . . . 0.0 104.743 164.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.512 ' H ' ' HD2' ' A' ' 44' ' ' LYS . 2.7 mptp? -39.08 -28.74 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 128.498 2.719 . . . . 0.0 117.898 -164.803 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -56.27 -17.11 16.82 Favored Glycine 0 CA--C 1.54 1.636 0 CA-C-N 120.033 1.288 . . . . 0.0 113.597 169.162 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -54.4 -24.1 18.47 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 127.965 2.506 . . . . 0.0 111.52 168.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.6 t -140.5 132.26 27.4 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-O 123.355 1.55 . . . . 0.0 113.33 -172.344 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 20.9 t -70.54 -52.23 30.8 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.717 0 CA-C-N 112.723 -2.035 . . . . 0.0 108.887 176.548 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.9 m -59.38 -45.49 93.39 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 CA-C-O 118.828 -0.606 . . . . 0.0 109.542 -179.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 35.1 t -62.88 -33.27 74.94 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.684 1.594 . . . . 0.0 109.953 -179.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 54.4 m -66.39 -25.19 66.66 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.24 0.616 . . . . 0.0 111.391 173.043 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.38 -47.57 28.22 Favored Glycine 0 N--CA 1.473 1.163 0 CA-C-O 124.527 2.182 . . . . 0.0 109.638 166.588 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.532 ' CE1' HD13 ' A' ' 35' ' ' LEU . 1.6 t80 -66.58 -36.6 83.02 Favored 'General case' 0 N--CA 1.408 -2.528 0 CA-C-N 110.917 -2.642 . . . . 0.0 116.325 -164.659 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -63.21 -23.04 67.25 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 118.281 -0.866 . . . . 0.0 111.634 173.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 55.6 mttp -66.67 -46.14 76.65 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 119.393 0.997 . . . . 0.0 109.368 169.168 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -60.34 -46.59 89.36 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.511 1.124 . . . . 0.0 110.734 175.149 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -65.49 -42.99 91.57 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.167 1.387 . . . . 0.0 109.845 -176.513 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 33.7 tp10 -61.08 -43.75 98.41 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 118.431 0.559 . . . . 0.0 110.728 173.316 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -57.85 -45.2 86.59 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 122.567 0.347 . . . . 0.0 110.794 173.259 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -68.33 -37.24 80.36 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.513 0.725 . . . . 0.0 111.474 -178.058 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 19.5 mt -59.28 -20.32 53.4 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 124.747 1.219 . . . . 0.0 112.481 179.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 52.7 p -56.91 -53.88 52.91 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.885 0.766 . . . . 0.0 110.078 169.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 7.1 tpm_? -80.94 -36.11 31.39 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 123.51 0.724 . . . . 0.0 111.804 -179.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -75.7 55.69 0.87 Allowed 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.206 1.002 . . . . 0.0 109.517 173.331 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.9 m -174.75 173.14 2.85 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 129.333 3.053 . . . . 0.0 107.755 176.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -153.22 173.89 14.96 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.43 1.492 . . . . 0.0 108.695 175.113 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 8.7 m -70.24 61.86 0.21 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.773 2.029 . . . . 0.0 112.623 -177.094 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt . . . . . 0 CA--C 1.531 0.225 0 C-N-CA 125.761 1.624 . . . . 0.0 110.477 -178.195 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.8 mmt . . . . . 0 C--O 1.238 0.458 0 CA-C-O 118.626 -0.702 . . . . 0.0 109.197 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -65.96 106.19 0.92 Allowed 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 123.467 2.778 . . . . 0.0 110.302 179.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 89.0 mm-40 -69.38 151.59 45.97 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 123.556 0.742 . . . . 0.0 110.459 179.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.423 ' H ' ' NH2' ' A' ' 46' ' ' ARG . 31.2 mtmm -135.97 174.09 10.99 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.814 1.646 . . . . 0.0 109.922 -175.433 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -137.27 85.01 22.66 Favored Pre-proline 0 CA--C 1.536 0.428 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 168.09 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -55.9 -29.85 74.73 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 124.54 3.493 . . . . 0.0 113.325 -171.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.419 ' HB3' ' CD2' ' A' ' 35' ' ' LEU . 88.7 m -96.78 -12.62 23.42 Favored 'General case' 0 N--CA 1.433 -1.28 0 C-N-CA 125.922 1.689 . . . . 0.0 113.905 -168.504 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 18.9 tp60 -62.02 -24.7 67.22 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 117.98 0.355 . . . . 0.0 111.627 -176.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.4 ttpp -70.88 -45.86 63.63 Favored 'General case' 0 CA--C 1.532 0.275 0 O-C-N 121.522 -0.736 . . . . 0.0 111.043 173.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -63.26 -40.36 97.19 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.458 0.703 . . . . 0.0 109.892 178.78 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -53.15 -40.51 64.32 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 124.631 1.172 . . . . 0.0 113.046 169.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 72.2 m -58.71 -46.05 88.18 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 110.443 -0.206 . . . . 0.0 110.443 174.022 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -60.93 -27.9 68.55 Favored 'General case' 0 CA--C 1.528 0.127 0 CA-C-O 118.112 -0.947 . . . . 0.0 112.691 178.437 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 21.8 mm -57.92 -54.32 33.49 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.473 0 CA-C-N 119.444 1.02 . . . . 0.0 109.339 173.522 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 36.0 mm-40 -58.15 -55.14 38.78 Favored 'General case' 0 N--CA 1.444 -0.764 0 O-C-N 124.365 1.041 . . . . 0.0 108.864 -177.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.65 -32.96 74.62 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 118.209 -1.396 . . . . 0.0 112.045 -175.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 31.0 t -56.46 -47.5 79.04 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 119.483 1.038 . . . . 0.0 109.127 169.561 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.96 -46.57 87.74 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 123.59 0.756 . . . . 0.0 110.629 179.368 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -57.08 -44.2 82.89 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.878 0.871 . . . . 0.0 111.293 173.546 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.91 -11.81 57.41 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.039 0.935 . . . . 0.0 113.434 174.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 50.2 m-80 -126.42 9.47 7.21 Favored 'General case' 0 C--N 1.343 0.31 0 C-N-CA 124.507 1.123 . . . . 0.0 112.656 -172.543 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 14.8 m 58.12 40.51 25.06 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 122.445 1.117 . . . . 0.0 111.05 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.255 6.7 m-85 71.99 13.02 6.0 Favored 'General case' 0 N--CA 1.444 -0.736 0 C-N-CA 127.888 2.475 . . . . 0.0 114.791 168.448 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 63.4 mtm -69.61 86.92 0.47 Allowed 'General case' 0 N--CA 1.441 -0.91 0 C-N-CA 125.116 1.367 . . . . 0.0 109.917 170.678 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -56.05 -20.94 19.01 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.089 0.556 . . . . 0.0 111.7 170.05 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 6.4 m -58.25 -37.39 74.84 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 127.56 2.344 . . . . 0.0 113.014 169.333 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 56.9 mmtt -75.75 -48.68 20.8 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 124.252 1.021 . . . . 0.0 108.736 173.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 83.9 m -71.33 6.57 1.68 Allowed 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 125.338 1.455 . . . . 0.0 112.95 -177.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -52.14 -32.34 35.24 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 120.129 1.332 . . . . 0.0 111.914 169.416 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.56 -56.23 24.54 Favored 'General case' 0 C--N 1.342 0.282 0 C-N-CA 125.117 1.367 . . . . 0.0 111.649 173.035 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.8 p -75.49 -29.51 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.872 0 C-N-CA 124.004 0.922 . . . . 0.0 109.934 -174.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.431 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 1.5 mp -58.38 -49.35 82.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 N-CA-C 105.648 -1.982 . . . . 0.0 105.648 167.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.75 -22.77 62.55 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 118.896 0.771 . . . . 0.0 112.778 177.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -76.82 -41.44 44.33 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 119.39 -0.924 . . . . 0.0 110.406 173.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.455 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 2.7 mt -62.8 -30.85 71.78 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 119.364 0.984 . . . . 0.0 110.667 170.354 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.2 mmt85 -62.4 -57.68 10.4 Favored 'General case' 0 C--N 1.339 0.135 0 CA-C-N 119.73 1.15 . . . . 0.0 108.307 176.266 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 20.4 pttm -69.62 -23.09 63.45 Favored 'General case' 0 C--O 1.234 0.241 0 O-C-N 123.484 0.49 . . . . 0.0 111.46 -175.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 46.7 t -68.21 -54.15 19.83 Favored 'General case' 0 N--CA 1.439 -1.0 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 166.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.0 t -61.55 -50.59 72.04 Favored 'General case' 0 CA--C 1.516 -0.362 0 C-N-CA 124.691 1.196 . . . . 0.0 112.912 -169.33 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.76 0.06 3.65 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.988 0.915 . . . . 0.0 112.82 -173.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.556 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 10.6 tt0 -84.58 -8.87 58.75 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 127.041 2.136 . . . . 0.0 111.378 179.075 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.556 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 81.5 m-85 -137.46 155.76 75.31 Favored Pre-proline 0 N--CA 1.439 -1.011 0 C-N-CA 126.813 2.045 . . . . 0.0 110.87 -166.635 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -69.51 105.99 1.54 Allowed 'Trans proline' 0 N--CA 1.457 -0.653 0 N-CA-C 104.233 -3.026 . . . . 0.0 104.233 165.754 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 63.0 pttt -39.27 -34.25 0.18 Allowed 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 118.772 2.878 . . . . 0.0 118.772 -163.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -55.3 -18.75 14.78 Favored Glycine 0 CA--C 1.541 1.684 0 CA-C-N 120.346 1.43 . . . . 0.0 114.202 172.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.423 ' NH2' ' H ' ' A' ' 4' ' ' LYS . 4.2 tpm_? -57.82 -15.73 9.26 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 128.069 2.547 . . . . 0.0 112.598 169.056 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.1 t -148.49 137.52 21.72 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-O 122.816 1.293 . . . . 0.0 111.587 177.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 15.9 t -68.08 -53.25 31.0 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 CA-C-N 113.867 -1.515 . . . . 0.0 108.664 177.369 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.6 m -60.57 -42.29 91.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 CA-C-O 118.768 -0.634 . . . . 0.0 110.217 -177.501 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . 0.424 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 13.0 t -64.61 -36.36 83.99 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.953 1.701 . . . . 0.0 110.274 177.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.9 m -66.04 -27.18 67.91 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 119.081 -0.485 . . . . 0.0 110.686 172.226 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.69 -36.18 67.04 Favored Glycine 0 C--N 1.343 0.968 0 CA-C-O 123.072 1.373 . . . . 0.0 111.457 168.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.455 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.8 OUTLIER -73.51 -42.5 61.72 Favored 'General case' 0 N--CA 1.422 -1.869 0 N-CA-C 116.438 2.014 . . . . 0.0 116.438 -164.783 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -65.01 -21.62 66.87 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-O 118.472 -0.775 . . . . 0.0 110.359 174.82 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -80.7 -41.62 23.36 Favored 'General case' 0 C--N 1.35 0.602 0 CA-C-N 119.416 1.007 . . . . 0.0 110.161 166.516 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -58.67 -35.82 73.19 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.556 0.742 . . . . 0.0 111.182 179.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -58.67 -41.71 86.75 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.497 1.119 . . . . 0.0 110.424 176.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -63.26 -42.15 99.11 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 123.027 0.531 . . . . 0.0 109.896 175.324 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 50.7 tt0 -57.13 -52.6 64.65 Favored 'General case' 0 C--N 1.341 0.218 0 CA-C-N 118.075 0.398 . . . . 0.0 110.382 172.476 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -64.02 -39.59 94.44 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 121.513 -0.742 . . . . 0.0 110.94 -173.2 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.7 pp -75.5 -31.42 60.18 Favored 'General case' 0 C--N 1.342 0.264 0 CA-C-O 118.414 -0.803 . . . . 0.0 110.952 -177.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -72.76 -34.83 67.26 Favored 'General case' 0 C--N 1.343 0.325 0 CA-C-N 119.187 0.903 . . . . 0.0 110.738 172.657 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 13.5 mtm180 -67.8 -23.49 65.21 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 118.263 0.483 . . . . 0.0 111.269 169.359 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.4 tppt? 57.27 36.91 27.9 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 127.484 2.314 . . . . 0.0 111.258 -171.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 68.8 p -67.35 164.49 18.43 Favored 'General case' 0 CA--C 1.539 0.524 0 O-C-N 121.85 -0.531 . . . . 0.0 109.682 169.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.25 47.65 0.12 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.2 1.8 . . . . 0.0 114.442 -170.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 4.4 m -68.8 75.91 0.3 Allowed 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 126.444 1.898 . . . . 0.0 111.141 176.035 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 23.3 pttp . . . . . 0 CA--C 1.535 0.384 0 C-N-CA 125.222 1.409 . . . . 0.0 109.994 171.677 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.9 mtm . . . . . 0 CA--C 1.54 0.58 0 CA-C-O 119.643 -0.218 . . . . 0.0 110.589 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -84.95 58.18 5.12 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 123.078 2.519 . . . . 0.0 111.935 -168.89 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 21.1 mp0 -62.14 -24.73 67.33 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.311 -0.868 . . . . 0.0 111.463 169.665 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 38.0 tptt -147.45 -174.04 4.42 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 127.833 2.453 . . . . 0.0 105.564 168.7 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -131.04 90.54 38.92 Favored Pre-proline 0 N--CA 1.449 -0.493 0 N-CA-C 108.65 -0.871 . . . . 0.0 108.65 170.808 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -58.51 -31.03 93.47 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 123.988 3.125 . . . . 0.0 112.865 -174.465 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 56.2 m -93.75 -10.27 34.81 Favored 'General case' 0 N--CA 1.438 -1.041 0 C-N-CA 125.06 1.344 . . . . 0.0 112.523 -171.91 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.6 tp60 -62.74 -26.58 68.77 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 118.821 0.737 . . . . 0.0 110.623 178.344 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -56.48 -54.09 49.84 Favored 'General case' 0 C--O 1.226 -0.168 0 C-N-CA 123.745 0.818 . . . . 0.0 109.942 169.364 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -63.94 -46.79 83.15 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 118.47 -0.776 . . . . 0.0 109.604 -178.202 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -51.06 -40.05 57.42 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.772 1.229 . . . . 0.0 112.969 171.3 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 61.2 m -62.2 -43.0 99.81 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 119.407 -0.33 . . . . 0.0 110.642 172.2 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -64.73 -29.97 70.96 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 117.346 -1.311 . . . . 0.0 112.981 177.339 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.9 mp -57.39 -50.58 76.49 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 CA-C-N 121.021 1.737 . . . . 0.0 109.166 169.26 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 34.2 mm-40 -59.53 -54.59 44.79 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 178.584 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 53.6 mmtt -68.42 -30.8 69.78 Favored 'General case' 0 C--O 1.227 -0.116 0 C-N-CA 118.697 -1.201 . . . . 0.0 111.418 -172.807 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 19.9 t -56.21 -48.94 75.44 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 168.488 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.68 -47.35 82.58 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 118.866 -0.588 . . . . 0.0 110.523 178.808 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -56.74 -46.49 81.33 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.528 0.731 . . . . 0.0 111.199 174.618 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.71 -13.71 59.82 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.113 0.965 . . . . 0.0 113.518 175.759 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.6 m-80 -122.05 8.18 9.82 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 124.772 1.229 . . . . 0.0 111.946 -173.385 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 58.08 40.42 25.25 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 119.566 1.076 . . . . 0.0 110.853 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.261 7.0 m-85 72.29 14.27 5.51 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 127.816 2.447 . . . . 0.0 114.457 168.876 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 68.4 mtm -70.4 82.42 0.56 Allowed 'General case' 0 N--CA 1.441 -0.882 0 C-N-CA 125.212 1.405 . . . . 0.0 109.793 169.836 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -53.19 -24.14 10.17 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.366 1.066 . . . . 0.0 111.668 171.684 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.6 m -52.11 -40.08 60.76 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 126.517 1.927 . . . . 0.0 112.409 170.113 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 45.7 mmtt -72.16 -48.62 42.07 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 124.481 1.113 . . . . 0.0 108.706 174.813 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 78.9 m -73.59 1.38 10.21 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.299 1.44 . . . . 0.0 113.614 -173.763 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 53.4 mm-40 -52.65 -34.13 50.1 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 119.681 1.128 . . . . 0.0 111.222 169.123 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.23 -54.86 42.02 Favored 'General case' 0 C--N 1.343 0.291 0 C-N-CA 125.02 1.328 . . . . 0.0 111.387 175.011 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.0 p -75.59 -31.19 22.81 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.831 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.236 -173.034 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 75.2 mt -58.98 -45.9 91.87 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 N-CA-C 106.656 -1.609 . . . . 0.0 106.656 168.489 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.37 -27.57 62.42 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 120.969 -1.082 . . . . 0.0 113.052 173.662 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -76.47 -29.78 57.03 Favored 'General case' 0 N--CA 1.437 -1.097 0 C-N-CA 119.571 -0.851 . . . . 0.0 110.86 175.656 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.434 ' HB3' ' CE2' ' A' ' 53' ' ' PHE . 3.6 mt -64.45 -29.71 70.76 Favored 'General case' 0 C--N 1.343 0.311 0 CA-C-N 119.688 1.131 . . . . 0.0 109.213 168.648 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 16.7 mmt85 -66.03 -55.81 14.77 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 119.805 1.184 . . . . 0.0 108.719 -178.808 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.9 pttp -66.25 -27.11 67.71 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.157 -178.83 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 42.7 t -65.43 -54.83 22.93 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 168.397 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.1 t -62.55 -46.38 88.63 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 124.127 0.971 . . . . 0.0 112.137 -169.191 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.55 -4.02 10.44 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.003 -0.999 . . . . 0.0 112.879 -178.241 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.421 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 2.8 tp-100 -86.2 -6.2 59.04 Favored 'General case' 0 N--CA 1.439 -1.014 0 C-N-CA 124.851 1.26 . . . . 0.0 111.697 -178.753 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.421 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 72.3 m-85 -136.0 159.76 69.87 Favored Pre-proline 0 N--CA 1.446 -0.642 0 C-N-CA 124.434 1.094 . . . . 0.0 111.387 -168.949 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -67.76 109.24 1.84 Allowed 'Trans proline' 0 N--CA 1.455 -0.764 0 N-CA-C 104.778 -2.816 . . . . 0.0 104.778 165.389 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 38.5 mmtm -39.78 -38.43 0.65 Allowed 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 117.164 2.283 . . . . 0.0 117.164 -165.372 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.58 -17.23 25.86 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 123.854 0.74 . . . . 0.0 113.936 175.718 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 2.0 ttm180 -66.77 -8.08 25.83 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 126.946 2.098 . . . . 0.0 112.653 172.266 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 5.8 t -147.34 136.21 22.14 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 122.912 1.339 . . . . 0.0 112.076 174.415 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 19.9 t -71.73 -50.78 36.54 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.74 0 CA-C-N 113.615 -1.63 . . . . 0.0 108.762 176.717 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.4 m -60.34 -43.68 94.25 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.335 0 CA-C-O 118.402 -0.809 . . . . 0.0 109.835 179.722 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 25.5 t -63.22 -34.57 77.94 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.011 1.724 . . . . 0.0 110.451 178.131 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 48.7 m -65.73 -28.93 69.41 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 122.998 0.519 . . . . 0.0 110.875 171.588 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -67.68 -40.71 90.19 Favored Glycine 0 C--N 1.344 0.995 0 CA-C-O 124.167 1.982 . . . . 0.0 110.952 167.432 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.434 ' CE2' ' HB3' ' A' ' 35' ' ' LEU . 1.2 t80 -73.94 -40.29 63.18 Favored 'General case' 0 N--CA 1.417 -2.122 0 CA-C-N 111.786 -2.207 . . . . 0.0 116.128 -164.581 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -65.56 -29.35 69.95 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 118.324 -0.846 . . . . 0.0 110.638 170.929 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 50.4 tptt -70.79 -37.11 73.28 Favored 'General case' 0 C--N 1.347 0.496 0 CA-C-N 119.716 1.143 . . . . 0.0 110.662 169.883 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -57.46 -43.24 83.85 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.011 0.525 . . . . 0.0 110.21 169.955 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -65.08 -38.81 91.96 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.828 1.251 . . . . 0.0 110.276 179.972 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -60.93 -32.98 72.46 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 118.723 0.692 . . . . 0.0 111.831 173.398 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.0 tp10 -71.32 -45.89 61.93 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.512 0.596 . . . . 0.0 110.107 169.267 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -66.33 -36.67 83.51 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 117.736 -1.126 . . . . 0.0 112.606 -171.599 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 4.1 pp -59.49 -14.73 13.8 Favored 'General case' 0 C--N 1.343 0.308 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -179.239 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 2.9 t -104.23 -53.99 2.62 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 124.541 1.136 . . . . 0.0 108.819 167.183 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.7 tmm_? -53.17 -41.18 64.93 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.721 1.208 . . . . 0.0 112.616 -169.966 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.06 26.02 6.15 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 124.192 0.997 . . . . 0.0 112.644 173.797 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 56.4 p 63.27 176.7 0.16 Allowed 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 127.13 2.172 . . . . 0.0 111.966 -169.805 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.41 12.86 0.08 Allowed 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.965 1.468 . . . . 0.0 114.965 176.716 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 26.6 m -72.53 39.15 0.08 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 129.502 3.121 . . . . 0.0 112.093 177.383 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 2.5 pptp? . . . . . 0 N--CA 1.453 -0.312 0 C-N-CA 124.42 1.088 . . . . 0.0 110.918 178.679 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.5 mtt . . . . . 0 N--CA 1.449 -0.502 0 CA-C-O 118.228 -0.891 . . . . 0.0 109.003 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -67.16 -5.17 13.05 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.84 2.36 . . . . 0.0 116.499 -172.582 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 13.7 mp0 -64.05 -26.44 68.56 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 126.751 2.021 . . . . 0.0 110.023 167.655 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -124.28 86.97 2.65 Favored 'General case' 0 N--CA 1.444 -0.733 0 C-N-CA 126.912 2.085 . . . . 0.0 106.138 169.667 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.8 t0 -90.62 109.04 31.47 Favored Pre-proline 0 CA--C 1.539 0.553 0 N-CA-C 106.245 -1.761 . . . . 0.0 106.245 -174.824 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -68.67 -17.79 42.63 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 125.097 3.865 . . . . 0.0 113.672 -169.532 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.417 ' HB3' ' CD2' ' A' ' 35' ' ' LEU . 98.6 m -105.32 -9.3 17.7 Favored 'General case' 0 N--CA 1.435 -1.224 0 C-N-CA 127.056 2.143 . . . . 0.0 111.835 -170.451 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 16.9 tp60 -67.41 -22.48 65.53 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.704 -171.467 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -70.36 -46.79 63.41 Favored 'General case' 0 C--O 1.225 -0.232 0 O-C-N 121.449 -0.782 . . . . 0.0 110.057 173.687 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 19.0 mp0 -65.27 -40.57 94.1 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 127.255 2.222 . . . . 0.0 108.237 -172.583 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -52.16 -43.26 63.99 Favored 'General case' 0 C--N 1.34 0.166 0 C-N-CA 126.166 1.787 . . . . 0.0 112.707 169.232 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 84.0 m -60.99 -45.13 96.06 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.925 0.393 . . . . 0.0 110.299 175.709 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -63.83 -22.54 66.96 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 117.711 -1.137 . . . . 0.0 112.541 179.278 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 31.6 mm -59.17 -54.72 30.36 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.216 0 CA-C-N 120.408 1.458 . . . . 0.0 109.17 171.271 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -61.52 -51.79 67.15 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 -177.739 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 16.6 mtpp -67.9 -30.72 70.14 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 118.245 -0.884 . . . . 0.0 111.568 -174.725 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 15.6 t -58.51 -47.87 82.71 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-N 119.41 1.004 . . . . 0.0 108.512 168.787 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.72 -47.15 83.24 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 123.339 0.655 . . . . 0.0 110.392 178.997 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -58.45 -42.23 86.9 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.983 0.913 . . . . 0.0 111.681 174.195 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.63 -10.68 57.58 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 174.374 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -128.33 9.02 6.07 Favored 'General case' 0 C--N 1.344 0.362 0 CA-C-N 119.421 1.009 . . . . 0.0 112.59 -171.852 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 16.2 m 61.03 38.87 16.96 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 119.496 1.044 . . . . 0.0 110.39 177.777 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.265 7.1 m-85 72.2 14.81 5.52 Favored 'General case' 0 N--CA 1.444 -0.735 0 C-N-CA 127.656 2.382 . . . . 0.0 114.431 168.788 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 58.7 mtm -70.9 85.94 0.69 Allowed 'General case' 0 N--CA 1.441 -0.9 0 C-N-CA 124.84 1.256 . . . . 0.0 109.881 170.616 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -52.56 -24.85 9.0 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.265 1.026 . . . . 0.0 111.149 169.556 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.4 m -53.77 -38.83 64.86 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 127.511 2.324 . . . . 0.0 113.013 170.409 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.411 ' HA ' ' HE2' ' A' ' 27' ' ' LYS . 9.9 mmpt? -75.74 -47.6 25.33 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 173.45 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.6 m -71.89 2.64 5.22 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.626 1.17 . . . . 0.0 113.401 -174.568 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -52.98 -30.96 38.16 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 119.439 1.018 . . . . 0.0 110.695 167.763 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.65 -59.58 5.21 Favored 'General case' 0 C--N 1.346 0.444 0 C-N-CA 125.616 1.566 . . . . 0.0 111.68 173.7 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.5 p -71.29 -29.5 36.14 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.716 0 C-N-CA 123.761 0.825 . . . . 0.0 110.08 -174.27 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.573 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 71.7 mt -59.91 -49.85 82.34 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 N-CA-C 106.543 -1.651 . . . . 0.0 106.543 169.239 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -56.86 -25.3 56.19 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 119.451 1.023 . . . . 0.0 112.909 175.482 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -74.84 -41.55 59.66 Favored 'General case' 0 N--CA 1.44 -0.953 0 CA-C-N 118.925 0.784 . . . . 0.0 110.819 173.802 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.47 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 2.4 mt -62.92 -31.31 72.35 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-O 117.797 -1.097 . . . . 0.0 110.208 170.447 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.9 mmt85 -63.37 -56.4 16.64 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 120.067 1.303 . . . . 0.0 108.443 179.076 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.8 pttt -67.65 -28.4 67.68 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.951 -174.517 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 47.8 t -66.55 -54.51 22.86 Favored 'General case' 0 N--CA 1.44 -0.925 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 168.246 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.8 t -59.48 -50.06 75.4 Favored 'General case' 0 CA--C 1.512 -0.512 0 C-N-CA 124.332 1.053 . . . . 0.0 111.842 -169.573 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.11 -1.53 6.15 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.025 -0.989 . . . . 0.0 112.414 -174.608 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.511 ' HB3' ' CE2' ' A' ' 42' ' ' TYR . 2.0 tp-100 -81.9 -10.28 59.34 Favored 'General case' 0 N--CA 1.436 -1.158 0 C-N-CA 124.344 1.058 . . . . 0.0 111.578 174.76 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.511 ' CE2' ' HB3' ' A' ' 41' ' ' GLN . 68.7 m-85 -138.71 158.91 69.32 Favored Pre-proline 0 N--CA 1.445 -0.712 0 C-N-CA 124.187 0.995 . . . . 0.0 112.014 -167.666 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -72.1 147.62 48.92 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 121.735 1.623 . . . . 0.0 108.373 167.622 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -51.94 -42.93 63.23 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 -173.669 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.96 -14.24 23.11 Favored Glycine 0 CA--C 1.53 0.974 0 CA-C-O 119.032 -0.871 . . . . 0.0 113.257 -178.858 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.54 -17.08 56.71 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 118.894 1.347 . . . . 0.0 113.095 176.052 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 9.6 t -151.95 128.51 10.74 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-O 123.537 1.636 . . . . 0.0 112.901 -175.234 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 12.0 t -68.5 -50.85 52.56 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 CA-C-N 112.679 -2.055 . . . . 0.0 108.698 178.942 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 16.0 m -61.84 -43.53 97.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 CA-C-O 118.46 -0.781 . . . . 0.0 110.083 -178.578 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 18.5 t -63.86 -34.58 78.26 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.582 1.553 . . . . 0.0 110.227 177.886 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.0 m -65.07 -29.64 70.54 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 122.788 0.435 . . . . 0.0 110.675 171.99 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.1 -37.54 82.44 Favored Glycine 0 C--N 1.344 1.002 0 CA-C-O 123.089 1.383 . . . . 0.0 111.104 167.987 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.573 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 1.3 t80 -75.08 -40.25 60.25 Favored 'General case' 0 N--CA 1.417 -2.075 0 N-CA-C 117.097 2.258 . . . . 0.0 117.097 -163.74 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -62.33 -21.31 65.18 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.674 171.853 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 35.0 mtmm -81.2 -45.63 16.05 Favored 'General case' 0 C--N 1.348 0.543 0 CA-C-N 119.563 1.074 . . . . 0.0 110.425 167.016 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -58.71 -29.66 66.84 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.95 1.3 . . . . 0.0 112.132 -179.37 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -58.46 -53.73 54.99 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 126.458 1.903 . . . . 0.0 108.979 174.867 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -62.29 -41.66 98.69 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.316 0.646 . . . . 0.0 110.281 175.308 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -56.78 -37.71 71.49 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 124.114 0.965 . . . . 0.0 111.817 178.879 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -80.14 -49.28 11.91 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 118.305 -0.855 . . . . 0.0 110.917 174.57 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 47.2 mt -55.82 -41.06 73.65 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 118.823 0.738 . . . . 0.0 111.505 -174.899 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -70.17 -41.15 74.17 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 122.181 0.192 . . . . 0.0 111.441 179.439 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 13.6 mtp-105 -83.16 -34.87 25.91 Favored 'General case' 0 N--CA 1.461 0.117 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 -173.371 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 24.7 mtpp -123.07 16.98 10.01 Favored 'General case' 0 C--O 1.23 0.056 0 C-N-CA 125.512 1.525 . . . . 0.0 113.99 -165.302 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 8.4 t 61.06 -164.55 0.24 Allowed 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.499 1.52 . . . . 0.0 111.341 -173.461 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -64.61 54.52 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 128.552 2.741 . . . . 0.0 115.719 -168.988 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 51.0 m -67.66 41.16 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 127.15 2.18 . . . . 0.0 113.938 171.41 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 63.9 tttm . . . . . 0 N--CA 1.456 -0.133 0 C-N-CA 125.018 1.327 . . . . 0.0 109.461 175.715 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.3 mtt . . . . . 0 CA--C 1.536 0.441 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -68.31 108.33 1.76 Allowed 'Trans proline' 0 N--CA 1.458 -0.583 0 C-N-CA 123.188 2.592 . . . . 0.0 109.608 176.575 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -64.58 -36.18 83.39 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 122.09 -0.381 . . . . 0.0 110.956 -176.107 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -74.37 33.07 0.09 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 127.307 2.243 . . . . 0.0 112.872 -178.819 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.0 t0 -128.36 97.48 28.28 Favored Pre-proline 0 N--CA 1.446 -0.669 0 C-N-CA 126.761 2.024 . . . . 0.0 108.935 -173.973 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -55.25 -34.58 88.75 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 124.091 3.194 . . . . 0.0 112.77 -173.695 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 85.7 m -94.9 -13.09 25.76 Favored 'General case' 0 N--CA 1.436 -1.168 0 C-N-CA 125.403 1.481 . . . . 0.0 113.581 -168.305 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.1 tp60 -61.29 -26.57 67.87 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 122.99 0.516 . . . . 0.0 110.803 -179.968 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.2 ttpp -62.29 -54.31 42.57 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.521 0.728 . . . . 0.0 110.377 169.971 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 27.1 mm-40 -59.12 -44.83 92.04 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.405 0.682 . . . . 0.0 110.107 -177.293 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -51.26 -42.58 61.17 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 125.728 1.611 . . . . 0.0 112.626 170.846 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.425 ' HB3' ' HE2' ' A' ' 16' ' ' LYS . 93.8 m -61.66 -46.27 90.45 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 117.854 0.297 . . . . 0.0 110.931 173.004 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -62.59 -22.22 66.21 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 117.662 -1.161 . . . . 0.0 112.633 179.091 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 27.3 mm -57.78 -53.61 42.67 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.218 0 CA-C-N 120.397 1.453 . . . . 0.0 109.614 171.796 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 -58.64 -55.85 29.75 Favored 'General case' 0 N--CA 1.445 -0.678 0 O-C-N 124.19 0.932 . . . . 0.0 109.002 -179.316 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.425 ' HE2' ' HB3' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -66.65 -31.54 72.28 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 118.807 -1.157 . . . . 0.0 112.138 -175.004 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 24.1 t -55.67 -48.72 74.58 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 119.491 1.041 . . . . 0.0 108.758 169.18 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.44 -46.7 86.02 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-O 118.863 -0.589 . . . . 0.0 110.48 179.533 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -57.03 -46.33 82.47 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.419 0.688 . . . . 0.0 111.34 174.402 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.49 -13.03 57.95 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.262 1.025 . . . . 0.0 113.4 175.66 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -123.21 8.54 9.16 Favored 'General case' 0 C--N 1.342 0.26 0 C-N-CA 124.66 1.184 . . . . 0.0 111.959 -173.333 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.3 m 58.23 40.13 25.08 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 119.636 1.107 . . . . 0.0 110.863 179.415 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.26 7.0 m-85 72.19 13.98 5.65 Favored 'General case' 0 N--CA 1.443 -0.796 0 C-N-CA 127.957 2.503 . . . . 0.0 114.499 168.902 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 67.0 mtm -69.93 84.72 0.5 Allowed 'General case' 0 N--CA 1.44 -0.955 0 C-N-CA 125.204 1.402 . . . . 0.0 109.837 170.002 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -53.79 -25.07 17.48 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.502 0.721 . . . . 0.0 111.524 171.105 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.2 m -53.1 -38.64 62.77 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 126.413 1.885 . . . . 0.0 112.631 170.691 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.8 mmtm -72.95 -47.73 42.95 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.267 1.027 . . . . 0.0 108.671 173.454 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.3 m -73.74 3.24 6.76 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 124.797 1.239 . . . . 0.0 113.637 -173.074 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 64.2 mm-40 -54.82 -29.72 55.46 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.2 -0.937 . . . . 0.0 110.542 167.067 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.71 -55.39 35.75 Favored 'General case' 0 C--N 1.345 0.4 0 C-N-CA 125.567 1.547 . . . . 0.0 111.708 172.606 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.5 p -75.81 -29.37 20.14 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 C-N-CA 123.605 0.762 . . . . 0.0 110.16 -173.467 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 59.2 mt -61.04 -46.78 96.0 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 N-CA-C 106.058 -1.83 . . . . 0.0 106.058 168.213 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.81 -26.58 62.18 Favored 'General case' 0 N--CA 1.453 -0.304 0 O-C-N 120.853 -1.155 . . . . 0.0 113.436 172.884 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -76.39 -32.32 58.49 Favored 'General case' 0 N--CA 1.432 -1.33 0 C-N-CA 119.492 -0.883 . . . . 0.0 110.743 175.705 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.8 mt -64.02 -32.83 74.51 Favored 'General case' 0 C--O 1.22 -0.455 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 168.46 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.4 mmt85 -64.71 -57.23 9.55 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 119.913 1.233 . . . . 0.0 109.24 -179.119 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.9 pttp -64.95 -29.64 70.58 Favored 'General case' 0 C--O 1.233 0.186 0 O-C-N 123.543 0.527 . . . . 0.0 111.087 -176.082 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 51.1 t -65.27 -54.19 32.95 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 168.729 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 48.7 t -62.6 -47.07 85.39 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 121.514 -0.741 . . . . 0.0 111.838 -169.921 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.53 -0.89 7.34 Favored 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 124.484 1.114 . . . . 0.0 112.429 -176.728 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.465 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 1.8 tp-100 -77.28 -11.52 59.84 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-N 119.1 0.864 . . . . 0.0 111.572 171.667 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.465 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 54.1 m-85 -141.44 160.64 56.25 Favored Pre-proline 0 N--CA 1.438 -1.053 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -164.23 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -69.82 114.85 3.85 Favored 'Trans proline' 0 N--CA 1.455 -0.758 0 N-CA-C 105.283 -2.622 . . . . 0.0 105.283 165.069 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.43 -29.57 1.14 Allowed 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 117.586 2.439 . . . . 0.0 117.586 -166.577 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -54.1 -17.16 7.16 Favored Glycine 0 CA--C 1.538 1.509 0 CA-C-N 119.601 1.091 . . . . 0.0 114.075 171.852 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.4 ' HG2' ' CG ' ' A' ' 42' ' ' TYR . 8.3 tpm_? -52.16 -29.15 20.81 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 127.589 2.356 . . . . 0.0 112.386 168.017 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.4 t -149.25 139.82 22.55 Favored 'General case' 0 N--CA 1.439 -1.012 0 CA-C-O 122.804 1.288 . . . . 0.0 112.048 -168.277 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.1 t -67.79 -55.03 18.4 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.658 0 CA-C-N 113.747 -1.569 . . . . 0.0 108.704 176.655 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.3 m -61.19 -43.2 95.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 CA-C-O 118.382 -0.818 . . . . 0.0 109.954 -177.106 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 29.5 t -64.57 -32.07 73.56 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.4 1.48 . . . . 0.0 110.18 178.934 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 52.3 m -67.25 -26.93 66.82 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 119.075 -0.488 . . . . 0.0 110.893 171.742 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -71.0 -36.15 64.58 Favored Glycine 0 C--N 1.345 1.05 0 CA-C-O 123.798 1.776 . . . . 0.0 111.092 167.288 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -78.47 -40.3 35.91 Favored 'General case' 0 N--CA 1.412 -2.339 0 N-CA-C 116.293 1.96 . . . . 0.0 116.293 -163.846 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -63.14 -29.25 70.65 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 119.483 -0.887 . . . . 0.0 110.342 170.858 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 19.4 tptp -69.02 -44.7 72.19 Favored 'General case' 0 C--N 1.349 0.564 0 CA-C-N 119.383 0.992 . . . . 0.0 110.408 170.513 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -55.05 -51.05 67.55 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.512 1.125 . . . . 0.0 109.6 176.123 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 72.1 tt0 -62.14 -35.89 80.14 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 126.255 1.822 . . . . 0.0 110.934 -178.249 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -61.28 -36.56 80.4 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.168 0.587 . . . . 0.0 111.286 173.834 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -63.44 -45.33 91.36 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-N 118.965 0.802 . . . . 0.0 109.674 171.099 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -68.71 -24.58 64.49 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 117.655 -1.164 . . . . 0.0 112.3 -171.791 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 49.0 mt -50.8 -22.29 2.08 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.204 1.002 . . . . 0.0 113.004 172.524 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 38.6 p -57.13 -70.1 0.14 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.28 1.032 . . . . 0.0 109.861 168.972 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -55.02 -50.91 67.86 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 126.391 1.877 . . . . 0.0 110.579 175.392 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.3 ttpm? -75.74 39.77 0.18 Allowed 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 128.085 2.554 . . . . 0.0 110.839 178.847 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.1 m -66.23 156.9 32.88 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 123.786 0.834 . . . . 0.0 110.076 171.606 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -157.5 -178.14 7.12 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 126.121 1.768 . . . . 0.0 107.798 176.777 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 71.9 p -70.85 65.1 0.33 Allowed 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.912 1.285 . . . . 0.0 109.925 169.589 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 90.6 mttt . . . . . 0 C--O 1.232 0.132 0 C-N-CA 125.318 1.447 . . . . 0.0 109.527 -176.111 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.546 0.803 0 CA-C-O 119.261 -0.4 . . . . 0.0 111.105 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -50.51 123.64 11.72 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 123.151 2.567 . . . . 0.0 110.866 170.433 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 67.8 mm-40 -75.94 45.91 0.36 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.675 1.59 . . . . 0.0 112.808 -169.891 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -68.43 158.7 33.11 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 167.635 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 47.3 t0 -93.3 102.01 6.65 Favored Pre-proline 0 CA--C 1.54 0.584 0 C-N-CA 123.217 0.607 . . . . 0.0 109.589 -173.132 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.54 -25.55 29.5 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 123.629 2.886 . . . . 0.0 112.4 -176.14 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 66.0 m -92.66 -11.51 33.93 Favored 'General case' 0 N--CA 1.435 -1.192 0 C-N-CA 124.518 1.127 . . . . 0.0 110.89 -170.699 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 21.4 tp60 -64.34 -25.0 67.84 Favored 'General case' 0 N--CA 1.442 -0.83 0 C-N-CA 123.36 0.664 . . . . 0.0 110.686 179.599 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -62.14 -53.83 49.79 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 123.477 0.711 . . . . 0.0 110.02 169.115 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -62.97 -38.89 92.9 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.043 0.537 . . . . 0.0 109.675 -176.662 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.32 -44.38 72.0 Favored 'General case' 0 C--N 1.342 0.272 0 C-N-CA 125.327 1.451 . . . . 0.0 112.222 169.784 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 85.3 m -58.54 -45.82 88.12 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 117.734 0.243 . . . . 0.0 110.531 173.573 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.0 mm-40 -67.3 -16.63 64.38 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 117.495 -1.24 . . . . 0.0 112.681 -179.864 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 42.2 mm -59.85 -54.3 36.59 Favored 'Isoleucine or valine' 0 C--N 1.34 0.17 0 CA-C-N 121.09 1.768 . . . . 0.0 107.847 169.118 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 50.9 mm-40 -57.27 -52.77 63.98 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.249 -0.887 . . . . 0.0 109.202 174.291 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 18.5 mmmt -65.34 -32.32 73.9 Favored 'General case' 0 C--N 1.334 -0.073 0 C-N-CA 118.741 -1.184 . . . . 0.0 111.757 -172.913 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 17.5 t -57.69 -51.45 69.47 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 169.72 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.65 -47.77 73.13 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.968 0.907 . . . . 0.0 110.876 178.229 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.461 ' HA ' ' CE1' ' A' ' 23' ' ' TYR . 0.6 OUTLIER -55.9 -45.36 78.68 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.024 0.93 . . . . 0.0 111.473 174.07 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.88 -10.99 60.57 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 114.381 1.252 . . . . 0.0 114.381 176.577 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -126.37 16.51 7.7 Favored 'General case' 0 C--N 1.343 0.321 0 CA-C-N 119.806 1.185 . . . . 0.0 113.749 -168.401 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 17.6 m 60.17 34.68 21.1 Favored 'General case' 0 C--N 1.345 0.401 0 CA-C-N 120.523 1.511 . . . . 0.0 110.285 -179.192 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.461 ' CE1' ' HA ' ' A' ' 19' ' ' GLN . 46.4 m-85 67.33 16.43 10.09 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 126.832 2.053 . . . . 0.0 113.719 168.406 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 65.2 mtm -73.7 90.98 1.86 Allowed 'General case' 0 N--CA 1.439 -0.987 0 C-N-CA 126.168 1.787 . . . . 0.0 109.114 175.368 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -54.68 -23.56 17.97 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.982 -0.449 . . . . 0.0 111.469 170.862 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.2 m -53.73 -41.32 66.94 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 126.588 1.955 . . . . 0.0 112.412 170.299 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 61.2 mmtt -71.29 -45.99 61.83 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 124.103 0.961 . . . . 0.0 108.891 173.581 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 86.3 m -73.97 3.47 6.79 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 124.336 1.054 . . . . 0.0 113.012 -172.88 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 79.8 mm-40 -56.45 -27.74 57.66 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.467 -0.771 . . . . 0.0 110.541 166.234 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.31 -60.46 3.78 Favored 'General case' 0 C--N 1.345 0.39 0 C-N-CA 125.403 1.481 . . . . 0.0 111.423 172.003 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.1 p -71.62 -25.92 25.35 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 C-N-CA 123.835 0.854 . . . . 0.0 110.004 -175.093 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 17.0 mt -60.02 -52.46 60.9 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 N-CA-C 106.684 -1.599 . . . . 0.0 106.684 168.101 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.452 ' HA ' ' CG ' ' A' ' 36' ' ' ARG . 8.6 tt0 -55.25 -36.65 66.29 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-O 118.792 -0.623 . . . . 0.0 110.305 178.588 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -65.25 -41.99 93.74 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 118.685 0.675 . . . . 0.0 111.703 176.065 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.538 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 0.7 OUTLIER -61.44 -38.59 87.72 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-O 117.005 -1.474 . . . . 0.0 110.418 173.236 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.533 HH21 ' NH2' ' A' ' 63' ' ' ARG 0.275 9.3 ptt85 -70.08 -39.76 75.4 Favored 'General case' 0 C--N 1.341 0.226 0 CA-C-N 120.66 1.573 . . . . 0.0 110.605 -179.865 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.8 mmtp -64.14 -37.1 86.22 Favored 'General case' 0 C--N 1.344 0.34 0 CA-C-N 118.716 0.689 . . . . 0.0 111.188 175.859 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 49.3 t -60.66 -53.18 60.5 Favored 'General case' 0 C--O 1.22 -0.448 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 170.528 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . 0.466 ' HA ' HH12 ' A' ' 46' ' ' ARG . 42.3 t -57.56 -44.97 85.64 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 125.306 1.443 . . . . 0.0 113.142 -169.646 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.33 -1.11 25.15 Favored 'General case' 0 N--CA 1.441 -0.902 0 O-C-N 124.67 1.231 . . . . 0.0 112.631 -176.268 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.457 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 3.5 tp-100 -91.86 -1.85 57.13 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 124.23 1.012 . . . . 0.0 112.754 -168.827 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.555 ' HB2' ' CZ ' ' A' ' 46' ' ' ARG . 84.7 m-85 -142.56 165.97 23.66 Favored Pre-proline 0 N--CA 1.443 -0.781 0 C-N-CA 125.985 1.714 . . . . 0.0 110.641 -167.474 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -61.93 139.93 82.21 Favored 'Trans proline' 0 CA--C 1.538 0.68 0 C-N-CA 121.798 1.665 . . . . 0.0 109.433 169.164 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm -71.44 -5.51 33.43 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 114.699 1.37 . . . . 0.0 114.699 -169.186 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -86.86 -12.79 68.01 Favored Glycine 0 CA--C 1.533 1.179 0 CA-C-O 118.636 -1.091 . . . . 0.0 113.669 169.933 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.555 ' CZ ' ' HB2' ' A' ' 42' ' ' TYR . 0.0 OUTLIER -74.39 -9.85 59.0 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.768 1.784 . . . . 0.0 112.757 -173.596 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.407 ' HB2' ' HD2' ' A' ' 46' ' ' ARG . 16.0 t -145.4 146.26 31.48 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 120.909 -1.119 . . . . 0.0 112.053 -174.656 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 23.6 t -84.26 -55.11 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 C-N-CA 126.177 1.791 . . . . 0.0 108.826 173.103 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.8 m -58.22 -41.35 80.75 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 118.212 0.46 . . . . 0.0 110.745 -173.724 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . 0.412 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 9.2 t -64.22 -34.48 78.19 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.281 1.433 . . . . 0.0 109.871 -179.928 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.1 p -64.94 -27.16 68.65 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 121.995 -0.44 . . . . 0.0 111.016 174.065 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.09 -45.12 58.01 Favored Glycine 0 C--N 1.348 1.196 0 CA-C-O 123.902 1.834 . . . . 0.0 110.172 168.391 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.538 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.6 OUTLIER -63.73 -39.74 95.04 Favored 'General case' 0 N--CA 1.415 -2.19 0 CA-C-N 111.937 -2.131 . . . . 0.0 115.354 -167.276 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -64.08 -22.53 66.97 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 118.649 -0.691 . . . . 0.0 111.079 178.747 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm -73.46 -38.88 65.31 Favored 'General case' 0 C--N 1.345 0.398 0 CA-C-N 119.186 0.903 . . . . 0.0 110.736 168.743 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -66.69 -28.53 68.52 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.808 -0.557 . . . . 0.0 111.826 171.972 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -64.6 -34.48 78.36 Favored 'General case' 0 C--O 1.227 -0.127 0 O-C-N 121.229 -0.919 . . . . 0.0 110.675 177.384 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -59.38 -39.56 83.73 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 118.411 0.55 . . . . 0.0 110.607 171.353 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -66.39 -47.4 73.43 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 122.538 0.335 . . . . 0.0 111.561 171.445 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -70.21 -22.85 62.88 Favored 'General case' 0 CA--C 1.522 -0.121 0 C-N-CA 124.113 0.965 . . . . 0.0 112.588 -173.63 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 15.2 mt -57.42 -11.53 1.97 Allowed 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 124.257 1.023 . . . . 0.0 113.211 172.883 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 27.2 p -62.95 -62.4 1.74 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.211 1.005 . . . . 0.0 108.862 166.496 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.533 ' NH2' HH21 ' A' ' 36' ' ' ARG . 11.8 ttp180 -60.74 -45.45 94.24 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 127.268 2.227 . . . . 0.0 111.96 174.547 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 22.7 pttp 42.73 15.36 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 131.323 3.849 . . . . 0.0 118.354 -175.598 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.4 t 54.64 -167.0 0.09 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.064 1.346 . . . . 0.0 111.117 -169.07 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.56 22.75 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.038 1.735 . . . . 0.0 115.021 -176.947 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 13.1 m -71.29 32.24 0.05 OUTLIER 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 129.31 3.044 . . . . 0.0 113.328 -175.829 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 13.0 mptt . . . . . 0 N--CA 1.446 -0.66 0 C-N-CA 125.983 1.713 . . . . 0.0 108.913 -175.633 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.7 mtp . . . . . 0 CA--C 1.537 0.452 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -75.42 61.2 5.94 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.605 2.87 . . . . 0.0 110.997 176.614 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -68.59 156.38 38.2 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.449 1.1 . . . . 0.0 110.471 177.625 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -74.36 55.35 0.61 Allowed 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.74 1.616 . . . . 0.0 110.551 170.994 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -128.12 105.64 20.01 Favored Pre-proline 0 N--CA 1.441 -0.883 0 C-N-CA 129.363 3.065 . . . . 0.0 108.343 -167.46 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -60.47 -16.63 43.21 Favored 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 124.31 3.34 . . . . 0.0 114.948 -173.65 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 64.2 m -108.57 -6.97 15.82 Favored 'General case' 0 N--CA 1.441 -0.92 0 C-N-CA 127.027 2.131 . . . . 0.0 112.272 -170.465 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 8.0 tp60 -67.89 -22.79 65.07 Favored 'General case' 0 N--CA 1.447 -0.597 0 O-C-N 121.615 -0.678 . . . . 0.0 112.278 -173.018 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 47.5 tptt -67.26 -49.56 63.93 Favored 'General case' 0 C--O 1.226 -0.143 0 CA-C-O 122.028 0.918 . . . . 0.0 109.446 173.456 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 20.4 mp0 -61.64 -43.13 99.44 Favored 'General case' 0 N--CA 1.442 -0.86 0 C-N-CA 127.641 2.377 . . . . 0.0 107.995 -173.962 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -53.78 -41.32 67.1 Favored 'General case' 0 C--N 1.341 0.213 0 C-N-CA 126.562 1.945 . . . . 0.0 114.016 169.797 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.0 m -63.27 -44.84 93.98 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 122.408 0.283 . . . . 0.0 110.263 173.716 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -64.83 -24.88 67.68 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 117.688 -1.148 . . . . 0.0 112.243 179.739 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 37.5 mm -56.54 -50.87 71.36 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.221 0 CA-C-N 120.273 1.397 . . . . 0.0 109.4 169.453 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 45.8 mm-40 -59.97 -56.28 23.68 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 106.971 -1.492 . . . . 0.0 106.971 -175.145 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 44.5 mttt -70.41 -30.19 67.0 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 118.182 -0.913 . . . . 0.0 111.233 -171.618 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 18.9 t -57.26 -47.06 82.37 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 169.185 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.26 -45.75 90.36 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 118.435 -0.793 . . . . 0.0 110.169 179.649 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -58.29 -45.68 87.5 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 119.328 0.967 . . . . 0.0 111.301 174.255 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.93 -13.94 58.53 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 175.862 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -123.86 9.25 8.8 Favored 'General case' 0 C--N 1.343 0.322 0 C-N-CA 124.302 1.041 . . . . 0.0 112.24 -172.928 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.4 m 58.03 40.45 25.39 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 122.404 1.097 . . . . 0.0 110.842 179.369 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.265 6.8 m-85 72.25 14.36 5.53 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 127.801 2.44 . . . . 0.0 114.428 168.79 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 63.0 mtm -69.45 86.27 0.44 Allowed 'General case' 0 N--CA 1.442 -0.843 0 C-N-CA 125.175 1.39 . . . . 0.0 110.329 170.122 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -54.36 -22.97 13.68 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.457 1.103 . . . . 0.0 111.323 169.486 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.6 m -58.02 -40.64 81.35 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 127.027 2.131 . . . . 0.0 112.631 170.085 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.7 mmtm -72.91 -47.73 43.2 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 124.138 0.975 . . . . 0.0 108.561 174.375 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.0 m -70.14 3.33 2.87 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.034 1.334 . . . . 0.0 113.424 -176.791 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.545 HE22 ' NH1' ' A' ' 63' ' ' ARG . 85.1 mm-40 -53.37 -31.7 45.86 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 119.304 0.956 . . . . 0.0 111.122 167.204 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.64 -50.16 74.93 Favored 'General case' 0 C--N 1.344 0.362 0 C-N-CA 125.028 1.331 . . . . 0.0 112.116 174.851 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.7 p -80.91 -29.96 11.66 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.809 0 C-N-CA 123.391 0.677 . . . . 0.0 109.845 -174.256 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.569 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 68.8 mt -63.25 -40.66 89.9 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 169.366 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.67 -34.71 59.61 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 123.727 0.811 . . . . 0.0 112.001 170.232 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -74.85 -42.8 57.25 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 119.806 -0.758 . . . . 0.0 110.846 179.504 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.458 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 2.4 mt -64.23 -30.9 71.94 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 118.276 -0.869 . . . . 0.0 110.311 174.425 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.22 -61.88 2.27 Favored 'General case' 0 CA--C 1.518 -0.269 0 C-N-CA 124.437 1.095 . . . . 0.0 108.756 175.661 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -64.58 -28.12 69.41 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 114.372 -1.286 . . . . 0.0 110.66 -173.499 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 49.4 t -66.28 -55.37 16.41 Favored 'General case' 0 N--CA 1.442 -0.83 0 C-N-CA 123.511 0.724 . . . . 0.0 109.258 168.273 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 47.8 t -60.0 -43.81 94.95 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 123.94 0.896 . . . . 0.0 112.516 -170.859 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.85 -4.32 15.85 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.845 -1.07 . . . . 0.0 113.006 -176.313 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.458 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 3.1 tp-100 -91.7 -4.82 54.67 Favored 'General case' 0 N--CA 1.437 -1.084 0 C-N-CA 125.355 1.462 . . . . 0.0 112.122 -172.6 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.458 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 78.9 m-85 -139.15 161.32 58.3 Favored Pre-proline 0 N--CA 1.446 -0.628 0 C-N-CA 124.132 0.973 . . . . 0.0 112.244 -168.133 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -69.48 98.99 0.69 Allowed 'Trans proline' 0 N--CA 1.456 -0.709 0 N-CA-C 105.096 -2.694 . . . . 0.0 105.096 165.384 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.514 ' H ' ' HD2' ' A' ' 44' ' ' LYS . 2.8 mptp? -39.34 -30.69 0.07 Allowed 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 117.904 2.557 . . . . 0.0 117.904 -165.556 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -54.81 -18.44 11.28 Favored Glycine 0 CA--C 1.541 1.659 0 CA-C-N 120.219 1.372 . . . . 0.0 114.097 170.021 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.0 tpm_? -55.8 -24.04 33.63 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 127.95 2.5 . . . . 0.0 112.053 168.957 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.5 t -144.64 130.16 18.93 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-O 123.387 1.565 . . . . 0.0 112.497 -172.298 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.7 t -69.82 -49.8 54.35 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.758 0 CA-C-N 112.952 -1.931 . . . . 0.0 108.72 176.677 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.4 m -62.58 -42.04 94.38 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-O 118.512 -0.756 . . . . 0.0 110.352 -178.319 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . 0.427 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 7.7 t -64.82 -35.28 80.6 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.757 1.623 . . . . 0.0 110.191 176.235 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.3 m -65.44 -28.9 69.56 Favored 'General case' 0 CA--C 1.535 0.398 0 O-C-N 122.082 -0.386 . . . . 0.0 110.525 171.727 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.56 -32.99 71.42 Favored Glycine 0 C--N 1.345 1.052 0 CA-C-O 122.801 1.223 . . . . 0.0 111.366 167.939 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.569 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 0.9 OUTLIER -80.21 -42.08 23.98 Favored 'General case' 0 N--CA 1.422 -1.839 0 N-CA-C 116.103 1.89 . . . . 0.0 116.103 -165.211 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -63.28 -26.04 68.59 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 119.841 -0.744 . . . . 0.0 110.404 171.014 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.424 ' HA ' ' HE3' ' A' ' 55' ' ' LYS . 1.3 tpmt? -73.38 -40.25 64.49 Favored 'General case' 0 C--N 1.347 0.477 0 CA-C-N 118.962 0.801 . . . . 0.0 110.454 168.641 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -59.31 -40.35 85.97 Favored 'General case' 0 C--O 1.221 -0.419 0 CA-C-N 118.48 0.582 . . . . 0.0 110.408 173.023 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -63.51 -40.83 98.09 Favored 'General case' 0 C--N 1.332 -0.165 0 C-N-CA 125.036 1.334 . . . . 0.0 110.155 179.128 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -58.69 -43.74 90.07 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 118.134 0.425 . . . . 0.0 110.5 170.283 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -61.16 -39.79 91.43 Favored 'General case' 0 CA--C 1.535 0.403 0 O-C-N 121.86 -0.525 . . . . 0.0 111.985 173.061 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -64.15 -29.46 70.58 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 124.646 1.178 . . . . 0.0 111.154 -178.466 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 89.8 mt -55.01 -34.42 63.43 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 118.862 0.755 . . . . 0.0 111.296 170.067 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 24.2 p -84.5 -49.08 8.94 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 124.693 1.197 . . . . 0.0 111.082 177.522 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.545 ' NH1' HE22 ' A' ' 29' ' ' GLN . 8.9 ttp180 -70.42 -29.32 65.89 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.427 1.491 . . . . 0.0 112.343 -171.832 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 53.8 mttp 60.61 168.07 0.09 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 129.809 3.243 . . . . 0.0 114.847 173.543 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 85.1 p 168.9 -177.72 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 130.683 3.593 . . . . 0.0 106.293 -176.041 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.8 9.03 0.98 Allowed 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 114.524 1.305 . . . . 0.0 114.524 169.18 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 7.7 t -140.9 37.13 1.78 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 128.2 2.6 . . . . 0.0 109.297 170.994 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 33.7 mmtp . . . . . 0 C--N 1.344 0.351 0 C-N-CA 126.213 1.805 . . . . 0.0 111.128 -172.094 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.446 -0.675 0 CA-C-O 119.301 -0.381 . . . . 0.0 111.083 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -80.85 -175.15 2.53 Favored 'Trans proline' 0 CA--C 1.545 1.026 0 C-N-CA 123.559 2.839 . . . . 0.0 110.53 169.098 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 59.43 -58.55 0.06 Allowed 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 129.658 3.183 . . . . 0.0 117.276 169.378 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.9 mppt? -64.57 160.52 19.39 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.656 1.182 . . . . 0.0 110.267 -171.989 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.2 t0 -94.46 102.1 7.99 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 124.94 1.296 . . . . 0.0 108.237 177.574 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -61.52 -30.95 87.23 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 125.247 3.964 . . . . 0.0 113.056 -172.36 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.441 ' HB3' ' CD2' ' A' ' 35' ' ' LEU . 87.9 m -94.16 -15.55 24.53 Favored 'General case' 0 N--CA 1.436 -1.163 0 C-N-CA 125.134 1.374 . . . . 0.0 112.497 -168.552 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 21.7 tp60 -61.15 -24.62 66.42 Favored 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 123.6 0.76 . . . . 0.0 111.181 -179.958 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -63.42 -56.13 18.71 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.48 0.712 . . . . 0.0 110.215 169.018 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -60.6 -37.85 82.75 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.475 0.71 . . . . 0.0 110.389 -176.423 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.41 -39.84 67.7 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 125.48 1.512 . . . . 0.0 113.759 170.039 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.1 m -61.08 -45.18 95.78 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 123.052 0.22 . . . . 0.0 110.445 171.873 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 32.0 mm-40 -63.86 -27.82 69.43 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-O 117.801 -1.095 . . . . 0.0 112.186 179.417 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.414 HD13 HG13 ' A' ' 31' ' ' VAL . 43.1 mm -56.33 -50.62 70.88 Favored 'Isoleucine or valine' 0 C--N 1.341 0.227 0 CA-C-N 120.106 1.321 . . . . 0.0 109.516 170.541 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 47.4 mm-40 -59.13 -56.08 26.75 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 107.218 -1.401 . . . . 0.0 107.218 -175.099 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 24.7 mttm -70.79 -30.67 67.2 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 118.366 -0.826 . . . . 0.0 111.317 -172.15 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 26.0 t -56.86 -46.97 81.44 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 168.571 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.2 -43.99 92.24 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.471 179.877 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.402 HE21 ' HE1' ' A' ' 23' ' ' TYR . 3.1 mp0 -58.17 -46.95 84.84 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 119.434 1.015 . . . . 0.0 111.114 173.378 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.91 -14.8 56.45 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 176.152 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 56.8 m-80 -122.76 10.91 9.67 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.826 1.25 . . . . 0.0 111.439 -173.693 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.9 m 55.5 41.14 31.12 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 122.56 1.171 . . . . 0.0 110.817 177.758 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.402 ' HE1' HE21 ' A' ' 19' ' ' GLN 0.255 6.5 m-85 71.85 12.86 6.15 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 128.544 2.738 . . . . 0.0 114.095 169.816 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 61.3 mtm -72.9 85.71 1.26 Allowed 'General case' 0 N--CA 1.437 -1.121 0 C-N-CA 125.323 1.449 . . . . 0.0 109.166 171.938 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -52.3 -25.66 10.1 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.214 1.006 . . . . 0.0 111.25 169.826 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.2 m -52.65 -36.7 57.24 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 127.145 2.178 . . . . 0.0 113.003 170.501 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 63.1 mttt -83.72 -40.85 18.34 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.588 0.755 . . . . 0.0 109.827 175.064 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 82.9 m -72.04 6.22 2.26 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.475 1.11 . . . . 0.0 113.341 179.433 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 67.7 mm-40 -56.29 -29.18 60.85 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 121.141 -0.974 . . . . 0.0 110.878 167.264 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.97 -55.03 37.7 Favored 'General case' 0 C--N 1.345 0.372 0 C-N-CA 125.285 1.434 . . . . 0.0 111.636 173.799 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.414 HG13 HD13 ' A' ' 14' ' ' ILE . 7.2 p -74.99 -28.75 21.33 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.677 0 C-N-CA 123.549 0.74 . . . . 0.0 109.742 -175.229 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 35.6 mt -61.55 -47.9 91.24 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 168.853 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.452 ' HA ' ' HG2' ' A' ' 36' ' ' ARG . 0.3 OUTLIER -50.76 -40.74 55.61 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 123.597 0.56 . . . . 0.0 110.328 173.456 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -68.64 -39.98 80.49 Favored 'General case' 0 N--CA 1.434 -1.27 0 C-N-CA 119.996 -0.682 . . . . 0.0 111.065 -178.943 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.508 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.3 mt -66.06 -38.94 89.59 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 117.688 -1.149 . . . . 0.0 111.058 174.7 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.496 ' HE ' ' HG2' ' A' ' 57' ' ' GLU . 3.6 ptm180 -67.72 -40.11 84.24 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 120.019 1.281 . . . . 0.0 110.112 179.155 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt -63.22 -42.32 99.24 Favored 'General case' 0 C--N 1.342 0.282 0 C-N-CA 123.131 0.572 . . . . 0.0 110.377 176.191 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 51.8 t -58.04 -51.59 69.04 Favored 'General case' 0 C--O 1.218 -0.589 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 172.298 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.7 t -57.83 -46.09 85.22 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 123.765 0.826 . . . . 0.0 112.069 -173.167 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.67 -0.51 7.02 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.438 -0.801 . . . . 0.0 113.149 -177.782 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.557 ' HB3' ' CE2' ' A' ' 42' ' ' TYR . 17.9 tt0 -83.7 -9.7 58.67 Favored 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 123.722 0.809 . . . . 0.0 111.013 175.799 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.557 ' CE2' ' HB3' ' A' ' 41' ' ' GLN . 80.8 m-85 -139.08 160.4 62.74 Favored Pre-proline 0 N--CA 1.445 -0.724 0 C-N-CA 124.766 1.226 . . . . 0.0 111.725 -167.682 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -68.05 132.47 26.33 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 N-CA-C 105.956 -2.363 . . . . 0.0 105.956 165.758 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -50.27 -42.22 51.85 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.355 1.243 . . . . 0.0 114.355 -167.026 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.78 -11.63 31.03 Favored Glycine 0 CA--C 1.531 1.051 0 CA-C-O 119.081 -0.844 . . . . 0.0 113.555 -178.87 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.61 -19.43 65.77 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 118.916 1.358 . . . . 0.0 112.361 172.471 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.9 t -145.34 136.77 25.13 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-O 122.964 1.364 . . . . 0.0 111.912 -176.929 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.7 t -69.93 -54.24 19.99 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.635 0 CA-C-N 113.697 -1.592 . . . . 0.0 108.701 -179.701 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.6 m -61.34 -38.3 79.61 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 C-N-CA 122.668 0.387 . . . . 0.0 110.232 -179.2 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . 0.47 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 11.2 t -66.6 -37.72 85.48 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.726 0.81 . . . . 0.0 109.751 177.354 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.5 m -64.82 -20.96 66.68 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 119.036 -0.507 . . . . 0.0 111.367 173.02 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -80.76 -23.67 59.53 Favored Glycine 0 C--N 1.345 1.031 0 CA-C-N 118.918 0.781 . . . . 0.0 112.3 169.161 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.508 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -80.88 -49.58 10.85 Favored 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 125.052 1.341 . . . . 0.0 114.04 -166.876 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -63.41 -19.6 64.82 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.549 176.105 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -76.5 -47.06 24.05 Favored 'General case' 0 C--N 1.346 0.429 0 C-N-CA 123.541 0.736 . . . . 0.0 109.947 166.525 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -53.19 -39.15 63.45 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.404 0.682 . . . . 0.0 111.041 174.111 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.496 ' HG2' ' HE ' ' A' ' 36' ' ' ARG . 34.8 mt-10 -64.43 -31.15 72.24 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 125.251 1.42 . . . . 0.0 112.114 -178.516 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -60.85 -41.52 96.0 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 169.468 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -59.2 -44.83 92.23 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 122.735 0.414 . . . . 0.0 110.284 175.211 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -62.24 -39.76 93.92 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 123.267 0.627 . . . . 0.0 110.355 179.346 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 37.2 mt -64.41 -28.48 69.71 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 117.997 -1.001 . . . . 0.0 112.318 174.191 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 30.8 p -70.05 -48.43 57.89 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 120.181 1.355 . . . . 0.0 110.184 168.745 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 33.8 mtp180 -62.99 -43.36 99.0 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 124.35 1.06 . . . . 0.0 111.482 -173.111 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -148.74 95.82 2.48 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 125.122 1.369 . . . . 0.0 107.802 170.916 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 5.0 m -64.28 136.02 56.78 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 173.835 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -173.47 177.95 2.46 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 126.525 1.93 . . . . 0.0 107.833 -175.399 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 39.6 t -70.17 43.19 0.06 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.693 1.597 . . . . 0.0 112.267 171.623 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp . . . . . 0 C--N 1.342 0.266 0 C-N-CA 125.308 1.443 . . . . 0.0 110.305 -175.106 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.5 mmt . . . . . 0 CA--C 1.538 0.515 0 CA-C-O 118.758 -0.639 . . . . 0.0 110.311 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -68.65 108.09 1.79 Allowed 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 122.585 2.19 . . . . 0.0 110.111 -176.121 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -135.09 -55.3 0.81 Allowed 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 126.927 2.091 . . . . 0.0 108.662 179.236 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -138.8 155.02 48.5 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 104.531 -2.396 . . . . 0.0 104.531 167.804 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.1 t0 -114.46 93.5 32.35 Favored Pre-proline 0 CA--C 1.536 0.418 0 C-N-CA 123.891 0.876 . . . . 0.0 109.349 -174.051 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -57.5 -32.72 94.95 Favored 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 124.09 3.193 . . . . 0.0 112.639 -175.594 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 95.3 m -94.23 -11.94 29.22 Favored 'General case' 0 N--CA 1.436 -1.15 0 C-N-CA 125.085 1.354 . . . . 0.0 113.497 -168.899 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 24.6 tp60 -62.5 -27.49 69.18 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 122.767 0.427 . . . . 0.0 110.602 178.224 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.45 -56.99 14.95 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.666 0.786 . . . . 0.0 108.92 169.579 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -64.01 -36.34 83.65 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 121.868 -0.52 . . . . 0.0 110.556 -176.722 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -60.24 -36.75 78.44 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.261 1.025 . . . . 0.0 112.472 172.619 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.6 m -65.72 -41.78 91.85 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 118.062 0.392 . . . . 0.0 111.031 169.248 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -62.61 -27.49 69.24 Favored 'General case' 0 C--O 1.226 -0.159 0 CA-C-O 117.639 -1.172 . . . . 0.0 112.159 177.907 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.413 HD13 HG13 ' A' ' 31' ' ' VAL . 46.2 mm -55.24 -52.37 46.03 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-N 120.098 1.317 . . . . 0.0 109.372 169.895 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 46.9 mm-40 -61.07 -49.75 76.1 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 -173.023 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.4 mtpm? -70.41 -37.37 74.43 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.236 1.014 . . . . 0.0 111.825 -176.015 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 12.9 t -54.27 -43.52 71.06 Favored 'General case' 0 CA--C 1.513 -0.458 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 170.134 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.94 -45.95 89.2 Favored 'General case' 0 N--CA 1.441 -0.909 0 O-C-N 123.57 0.544 . . . . 0.0 109.644 -178.075 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.426 ' HA ' ' CE1' ' A' ' 23' ' ' TYR . 4.3 mm-40 -64.38 -41.75 96.51 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 119.138 0.881 . . . . 0.0 110.604 179.291 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.39 -11.24 14.51 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 171.833 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 55.2 m-80 -127.17 10.45 6.87 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.216 1.406 . . . . 0.0 112.105 -176.567 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 5.4 m 55.1 40.93 32.03 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 122.554 1.168 . . . . 0.0 111.859 -179.904 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.426 ' CE1' ' HA ' ' A' ' 19' ' ' GLN 0.257 7.1 m-85 74.03 13.46 4.08 Favored 'General case' 0 N--CA 1.443 -0.796 0 C-N-CA 128.827 2.851 . . . . 0.0 114.371 168.464 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 67.5 mtm -70.07 84.3 0.52 Allowed 'General case' 0 N--CA 1.441 -0.909 0 C-N-CA 125.063 1.345 . . . . 0.0 109.708 170.248 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -54.26 -24.88 20.52 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.301 0.64 . . . . 0.0 111.499 172.809 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 8.4 t -56.69 -34.93 67.9 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.304 1.042 . . . . 0.0 112.42 172.656 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.9 mmtm -72.99 -46.17 53.76 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.997 0.919 . . . . 0.0 108.527 173.176 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 84.0 m -72.05 1.65 7.02 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 124.363 1.065 . . . . 0.0 113.035 -174.853 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 77.3 mm-40 -57.94 -23.85 55.34 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 120.02 1.282 . . . . 0.0 110.364 166.047 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.58 -56.55 20.76 Favored 'General case' 0 C--N 1.347 0.477 0 C-N-CA 126.043 1.737 . . . . 0.0 111.692 169.5 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.413 HG13 HD13 ' A' ' 14' ' ' ILE . 12.4 p -76.63 -26.23 16.43 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 C-N-CA 123.43 0.692 . . . . 0.0 109.932 -174.932 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.529 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 60.3 mt -61.52 -46.69 96.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 167.829 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.403 ' HA ' ' HG3' ' A' ' 36' ' ' ARG . 0.4 OUTLIER -54.84 -38.98 68.09 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 119.291 0.951 . . . . 0.0 112.285 171.062 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -67.7 -39.43 84.38 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 118.771 0.714 . . . . 0.0 110.478 178.796 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.568 HD13 ' CE1' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -66.55 -27.08 67.47 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 124.932 1.293 . . . . 0.0 109.003 175.918 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.403 ' HG3' ' HA ' ' A' ' 33' ' ' GLN . 7.9 mmt-85 -70.79 -48.79 52.39 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 176.315 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 28.1 mmtp -60.91 -31.24 70.76 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 123.575 0.547 . . . . 0.0 111.363 177.834 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 43.1 t -67.06 -58.79 4.24 Favored 'General case' 0 N--CA 1.44 -0.964 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 168.455 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 38.8 t -61.52 -39.58 91.54 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 121.115 -0.991 . . . . 0.0 113.17 -169.173 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.47 -2.02 12.62 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 -175.605 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.563 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 12.1 tt0 -94.63 -7.21 41.54 Favored 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 127.43 2.292 . . . . 0.0 111.448 -171.086 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.563 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 78.4 m-85 -138.77 161.18 59.78 Favored Pre-proline 0 N--CA 1.447 -0.602 0 C-N-CA 124.445 1.098 . . . . 0.0 112.063 -167.877 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -67.79 121.03 8.05 Favored 'Trans proline' 0 N--CA 1.456 -0.713 0 N-CA-C 104.792 -2.811 . . . . 0.0 104.792 164.436 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.9 mmtt -51.35 -33.06 27.94 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 -166.025 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.88 -14.89 32.62 Favored Glycine 0 CA--C 1.533 1.18 0 C-N-CA 124.334 0.969 . . . . 0.0 113.913 176.313 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.9 tpm_? -57.12 -31.45 65.32 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 125.32 1.448 . . . . 0.0 111.247 169.446 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.6 t -136.64 134.8 37.71 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-O 123.372 1.558 . . . . 0.0 112.62 -168.781 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 15.6 t -68.91 -54.04 22.78 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.699 0 CA-C-N 112.789 -2.005 . . . . 0.0 108.425 177.044 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 5.1 m -60.72 -43.5 95.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.47 0 CA-C-O 118.241 -0.885 . . . . 0.0 109.814 -177.969 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 43.4 t -63.11 -32.05 73.34 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.427 1.491 . . . . 0.0 110.284 179.949 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.2 m -68.81 -27.72 66.11 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.059 0.544 . . . . 0.0 111.079 172.108 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.99 -35.17 78.22 Favored Glycine 0 C--N 1.345 1.031 0 CA-C-O 123.794 1.774 . . . . 0.0 111.525 167.357 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.568 ' CE1' HD13 ' A' ' 35' ' ' LEU . 1.5 t80 -80.78 -40.34 25.27 Favored 'General case' 0 N--CA 1.415 -2.216 0 N-CA-C 117.162 2.282 . . . . 0.0 117.162 -162.687 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -68.24 -21.77 64.81 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 118.64 -0.695 . . . . 0.0 110.337 169.527 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -74.9 -37.7 62.03 Favored 'General case' 0 C--N 1.349 0.554 0 CA-C-N 119.439 1.018 . . . . 0.0 109.671 166.874 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -58.72 -34.42 71.32 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 119.051 0.841 . . . . 0.0 110.707 170.465 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -62.93 -33.79 76.08 Favored 'General case' 0 CA--C 1.532 0.27 0 O-C-N 121.728 -0.608 . . . . 0.0 111.131 178.099 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -64.35 -29.86 70.92 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.237 1.015 . . . . 0.0 111.44 173.73 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -76.18 -43.57 42.02 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 121.759 -0.588 . . . . 0.0 110.246 169.258 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -66.0 -32.18 73.52 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 121.646 -0.659 . . . . 0.0 111.451 -175.257 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.8 pp -62.76 -5.68 2.98 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 176.363 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 46.6 p -64.19 -53.1 54.58 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.7 1.136 . . . . 0.0 109.249 167.386 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 41.2 ttp180 -58.61 -32.38 68.95 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 125.531 1.532 . . . . 0.0 110.389 169.393 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 58.96 33.06 22.81 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 125.106 1.363 . . . . 0.0 111.689 171.973 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 27.3 m -165.14 172.07 13.0 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 127.403 2.281 . . . . 0.0 107.139 174.985 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . 39.13 50.19 1.81 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.161 1.385 . . . . 0.0 111.494 -173.057 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 69.8 m -127.86 28.98 5.51 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 126.052 1.741 . . . . 0.0 111.175 -171.171 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.162 0 C-N-CA 126.298 1.839 . . . . 0.0 108.193 179.421 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 mmt . . . . . 0 CA--C 1.536 0.421 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -75.63 24.93 0.41 Allowed 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 123.767 2.978 . . . . 0.0 114.334 -174.672 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -74.04 22.08 0.09 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 128.638 2.775 . . . . 0.0 113.325 -174.693 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 54.7 tptt -59.2 150.1 26.49 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.379 1.072 . . . . 0.0 110.085 177.358 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.0 t0 -123.77 93.85 46.78 Favored Pre-proline 0 N--CA 1.445 -0.723 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 168.784 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -59.04 -18.3 42.6 Favored 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 124.827 3.685 . . . . 0.0 115.053 -172.354 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 65.5 m -110.55 -8.49 14.63 Favored 'General case' 0 N--CA 1.438 -1.069 0 C-N-CA 126.888 2.075 . . . . 0.0 113.206 -168.473 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 18.5 tp60 -66.54 -23.97 66.3 Favored 'General case' 0 N--CA 1.445 -0.717 0 O-C-N 121.916 -0.49 . . . . 0.0 111.987 -173.258 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -69.07 -45.09 71.21 Favored 'General case' 0 C--O 1.225 -0.191 0 CA-C-O 121.827 0.822 . . . . 0.0 110.069 174.433 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.9 mp0 -65.74 -40.75 92.44 Favored 'General case' 0 N--CA 1.443 -0.807 0 C-N-CA 127.317 2.247 . . . . 0.0 108.098 -175.318 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.66 -44.43 73.28 Favored 'General case' 0 C--N 1.341 0.225 0 C-N-CA 125.474 1.51 . . . . 0.0 112.504 168.556 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 70.9 m -59.27 -43.87 92.47 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 110.424 -0.213 . . . . 0.0 110.424 175.399 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -63.96 -21.02 66.3 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 117.584 -1.198 . . . . 0.0 112.518 178.73 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 26.3 mm -59.75 -54.97 27.22 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.193 0 CA-C-N 120.587 1.54 . . . . 0.0 108.942 171.788 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -57.61 -54.25 49.03 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 115.163 -0.926 . . . . 0.0 108.848 178.343 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 57.2 mmtt -68.57 -30.64 69.45 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 118.567 -1.253 . . . . 0.0 111.592 -172.757 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 19.9 t -56.82 -48.85 77.05 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 168.789 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.76 -46.81 84.01 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 123.099 0.56 . . . . 0.0 110.477 179.55 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -57.22 -45.96 83.37 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.708 0.803 . . . . 0.0 111.267 174.204 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.85 -12.78 57.03 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 175.387 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -124.21 8.6 8.54 Favored 'General case' 0 C--N 1.342 0.264 0 C-N-CA 124.592 1.157 . . . . 0.0 112.29 -172.524 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 m 58.6 40.1 23.96 Favored 'General case' 0 C--N 1.345 0.389 0 CA-C-O 122.414 1.102 . . . . 0.0 110.846 179.42 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.264 7.1 m-85 72.09 13.88 5.77 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 127.849 2.459 . . . . 0.0 114.612 168.72 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 66.0 mtm -69.83 85.84 0.5 Allowed 'General case' 0 N--CA 1.441 -0.91 0 C-N-CA 125.063 1.345 . . . . 0.0 110.107 170.148 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -53.9 -24.47 16.24 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.505 0.722 . . . . 0.0 111.698 170.643 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.1 m -53.65 -40.56 65.97 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 126.299 1.839 . . . . 0.0 112.335 170.631 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.4 mmtm -71.85 -47.28 54.15 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 124.201 1.0 . . . . 0.0 108.754 174.132 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 70.9 m -74.22 4.29 5.93 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 124.78 1.232 . . . . 0.0 113.418 -173.626 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 59.4 mm-40 -54.9 -32.29 60.89 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 119.131 0.878 . . . . 0.0 109.894 166.846 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.96 -53.0 63.0 Favored 'General case' 0 C--N 1.345 0.39 0 C-N-CA 124.582 1.153 . . . . 0.0 111.676 174.709 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.7 p -77.54 -27.15 15.46 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.78 0 C-N-CA 123.439 0.696 . . . . 0.0 110.027 -174.296 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.529 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 53.7 mt -63.18 -44.03 99.13 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 168.581 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -57.92 -29.74 65.37 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 118.966 0.803 . . . . 0.0 111.768 173.193 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -70.17 -47.5 61.34 Favored 'General case' 0 N--CA 1.443 -0.822 0 CA-C-N 118.69 0.677 . . . . 0.0 111.557 173.458 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.471 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.7 mt -61.9 -31.6 71.91 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 118.958 0.799 . . . . 0.0 110.239 176.759 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.73 -59.72 4.96 Favored 'General case' 0 CA--C 1.52 -0.208 0 C-N-CA 125.948 1.699 . . . . 0.0 109.956 175.2 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -63.47 -34.79 78.55 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 114.715 -1.13 . . . . 0.0 110.922 -177.256 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 42.8 t -62.22 -51.64 66.97 Favored 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 169.726 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 52.5 t -64.36 -48.73 74.41 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 123.7 0.8 . . . . 0.0 112.003 -170.173 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.85 -1.3 5.28 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 124.216 1.006 . . . . 0.0 112.339 -175.707 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.488 ' HB3' ' CD2' ' A' ' 42' ' ' TYR . 2.2 tp-100 -81.32 -8.22 59.71 Favored 'General case' 0 N--CA 1.437 -1.085 0 C-N-CA 125.005 1.322 . . . . 0.0 111.288 175.033 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.488 ' CD2' ' HB3' ' A' ' 41' ' ' GLN . 82.0 m-85 -142.04 160.4 55.52 Favored Pre-proline 0 N--CA 1.443 -0.818 0 C-N-CA 125.015 1.326 . . . . 0.0 111.907 -167.438 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -69.37 124.95 11.76 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 N-CA-C 105.641 -2.484 . . . . 0.0 105.641 165.234 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -47.11 -35.75 7.5 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 116.205 1.928 . . . . 0.0 116.205 -166.947 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.9 -14.56 17.06 Favored Glycine 0 CA--C 1.534 1.265 0 C-N-CA 124.515 1.055 . . . . 0.0 114.051 177.946 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 9.0 tpm_? -54.83 -28.46 49.82 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 126.401 1.88 . . . . 0.0 112.348 168.62 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.0 t -149.69 140.37 22.61 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-O 122.623 1.202 . . . . 0.0 111.531 -168.968 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 10.5 t -69.47 -54.24 20.67 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.691 0 CA-C-N 114.019 -1.446 . . . . 0.0 108.617 178.028 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.5 m -61.07 -40.49 85.85 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 C-N-CA 122.916 0.486 . . . . 0.0 110.334 -177.542 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . 0.475 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 12.6 t -67.1 -36.04 81.07 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.716 1.206 . . . . 0.0 109.905 177.473 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 53.3 m -65.51 -27.59 68.58 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 121.773 -0.579 . . . . 0.0 110.873 172.476 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -71.14 -27.91 71.12 Favored Glycine 0 C--N 1.345 1.047 0 CA-C-O 122.125 0.847 . . . . 0.0 112.06 169.425 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.529 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 0.2 OUTLIER -80.95 -47.66 13.37 Favored 'General case' 0 N--CA 1.428 -1.574 0 C-N-CA 125.727 1.611 . . . . 0.0 114.801 -166.965 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -63.2 -25.48 68.36 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 119.517 -0.873 . . . . 0.0 110.152 173.626 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 10.1 mtmp? -71.03 -37.21 72.57 Favored 'General case' 0 C--N 1.347 0.465 0 CA-C-N 118.984 0.811 . . . . 0.0 110.814 167.796 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -57.94 -40.11 79.69 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 118.919 0.781 . . . . 0.0 110.107 169.139 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -66.31 -38.95 88.89 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 119.46 1.027 . . . . 0.0 111.318 175.3 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -61.36 -37.54 83.71 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.977 0.808 . . . . 0.0 110.95 170.093 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -64.72 -36.72 85.19 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 118.948 0.795 . . . . 0.0 111.689 172.416 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.409 ' ND2' ' HE ' ' A' ' 63' ' ' ARG . 1.1 m-80 -61.38 -26.32 67.76 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 123.872 0.869 . . . . 0.0 112.269 179.814 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 85.3 mt -53.92 -27.18 29.11 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.263 0.625 . . . . 0.0 112.281 169.808 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 27.7 p -81.3 -46.77 14.25 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 124.5 1.12 . . . . 0.0 111.313 173.644 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.409 ' HE ' ' ND2' ' A' ' 60' ' ' ASN . 29.0 mtm180 -62.78 -46.98 85.5 Favored 'General case' 0 C--O 1.233 0.187 0 C-N-CA 124.886 1.274 . . . . 0.0 110.966 -176.116 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -78.09 62.48 2.85 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.661 1.584 . . . . 0.0 110.352 -175.131 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.8 m 55.98 -161.04 0.19 Allowed 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.158 0.983 . . . . 0.0 111.102 -178.098 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.75 29.45 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.669 1.587 . . . . 0.0 115.19 -177.317 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 44.4 m -72.36 26.64 0.05 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 127.216 2.206 . . . . 0.0 113.722 -178.252 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 48.8 mmtm . . . . . 0 N--CA 1.454 -0.264 0 C-N-CA 125.89 1.676 . . . . 0.0 109.954 -170.076 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.6 mtt . . . . . 0 CA--C 1.538 0.487 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -49.93 136.25 36.27 Favored 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 122.92 2.414 . . . . 0.0 111.227 171.381 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -71.57 40.73 0.07 Allowed 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 127.473 2.309 . . . . 0.0 113.082 -174.928 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 35.3 mmtp -61.67 126.8 28.63 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 106.761 -1.57 . . . . 0.0 106.761 169.021 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -91.9 100.27 3.3 Favored Pre-proline 0 CA--C 1.537 0.464 0 C-N-CA 124.106 0.962 . . . . 0.0 109.125 -168.862 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_exo -60.57 -31.34 92.18 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 123.599 2.866 . . . . 0.0 112.781 -171.809 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.414 ' HB3' ' CD2' ' A' ' 35' ' ' LEU . 77.7 m -94.25 -13.17 26.82 Favored 'General case' 0 N--CA 1.438 -1.069 0 C-N-CA 125.194 1.398 . . . . 0.0 112.558 -169.45 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.0 tp60 -61.7 -25.23 67.29 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 123.131 0.572 . . . . 0.0 110.855 177.804 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.8 tttm -60.14 -56.58 19.83 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.824 1.25 . . . . 0.0 109.962 168.118 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -62.99 -36.97 85.3 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.355 0.662 . . . . 0.0 110.568 -177.992 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.63 -43.95 72.75 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 124.854 1.262 . . . . 0.0 112.214 169.388 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 80.8 m -57.93 -43.5 86.32 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 121.174 -0.21 . . . . 0.0 110.965 172.96 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -63.61 -23.56 67.43 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-O 117.751 -1.119 . . . . 0.0 112.491 178.728 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 26.4 mm -59.36 -54.72 30.39 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.226 0 CA-C-N 120.128 1.331 . . . . 0.0 108.833 172.531 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 33.0 mm-40 -59.2 -53.07 62.49 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.422 179.467 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.34 -33.08 74.93 Favored 'General case' 0 C--N 1.333 -0.111 0 C-N-CA 118.703 -1.199 . . . . 0.0 111.568 -175.811 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 23.6 t -56.1 -47.68 77.59 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 119.271 0.941 . . . . 0.0 108.944 169.329 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.07 -46.83 84.78 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 123.516 0.727 . . . . 0.0 110.682 178.8 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -57.4 -43.83 84.05 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.72 0.808 . . . . 0.0 111.305 173.782 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.5 -11.96 59.19 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.076 0.95 . . . . 0.0 113.477 174.631 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 -125.66 8.63 7.62 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 124.719 1.208 . . . . 0.0 112.358 -172.029 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.1 m 58.56 40.17 24.0 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-N 119.494 1.043 . . . . 0.0 110.903 179.78 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.257 6.9 m-85 71.71 13.34 6.24 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 127.654 2.382 . . . . 0.0 114.779 168.614 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 64.4 mtm -70.17 84.61 0.54 Allowed 'General case' 0 N--CA 1.441 -0.892 0 C-N-CA 125.184 1.394 . . . . 0.0 109.722 170.082 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -54.63 -24.27 20.78 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 119.063 -0.494 . . . . 0.0 111.637 172.335 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.8 m -51.77 -44.05 63.22 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 126.452 1.901 . . . . 0.0 112.141 170.076 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.4 mmtm -67.75 -48.49 66.26 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 124.175 0.99 . . . . 0.0 108.687 174.651 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.422 ' O ' HG12 ' A' ' 31' ' ' VAL . 73.2 m -72.73 2.71 6.1 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 124.973 1.309 . . . . 0.0 113.302 -174.748 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 45.9 mm-40 -56.3 -26.64 52.82 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 120.078 1.308 . . . . 0.0 111.281 168.159 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.34 -51.38 69.64 Favored 'General case' 0 C--N 1.345 0.392 0 C-N-CA 125.537 1.535 . . . . 0.0 112.184 169.951 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.422 HG12 ' O ' ' A' ' 28' ' ' CYS . 9.7 p -80.71 -26.09 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.888 0 C-N-CA 123.698 0.799 . . . . 0.0 109.657 -174.759 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.5 mp -60.51 -48.52 88.15 Favored 'Isoleucine or valine' 0 C--N 1.35 0.593 0 N-CA-C 105.689 -1.967 . . . . 0.0 105.689 166.214 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.454 ' HA ' ' HG2' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -52.98 -37.63 61.48 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 123.212 0.605 . . . . 0.0 110.886 176.514 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -70.91 -39.49 72.69 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 120.072 -0.651 . . . . 0.0 110.974 179.669 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.549 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.0 OUTLIER -64.4 -36.83 85.41 Favored 'General case' 0 C--N 1.342 0.279 0 CA-C-O 117.877 -1.059 . . . . 0.0 110.765 174.663 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.473 ' HE ' ' HG2' ' A' ' 57' ' ' GLU . 0.0 OUTLIER -68.12 -40.5 82.51 Favored 'General case' 0 C--N 1.341 0.219 0 CA-C-N 119.775 1.17 . . . . 0.0 110.215 178.347 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 57.2 mttp -63.49 -39.55 94.73 Favored 'General case' 0 C--N 1.341 0.218 0 CA-C-O 119.232 -0.413 . . . . 0.0 111.012 175.536 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.1 t -59.33 -52.74 64.34 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 171.937 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.1 t -57.74 -48.87 78.4 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 124.034 0.934 . . . . 0.0 112.048 -171.663 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.12 -1.25 7.26 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.241 -0.89 . . . . 0.0 112.722 -175.148 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.539 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 21.2 tt0 -84.15 -12.09 55.52 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 125.203 1.401 . . . . 0.0 111.345 179.088 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.539 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 76.4 m-85 -133.02 157.87 77.26 Favored Pre-proline 0 N--CA 1.447 -0.617 0 C-N-CA 124.174 0.99 . . . . 0.0 112.003 -168.146 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -67.31 109.43 1.78 Allowed 'Trans proline' 0 N--CA 1.453 -0.898 0 N-CA-C 104.878 -2.778 . . . . 0.0 104.878 165.501 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.88 -27.48 0.53 Allowed 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 117.199 2.296 . . . . 0.0 117.199 -166.773 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.47 -18.44 29.92 Favored Glycine 0 CA--C 1.536 1.369 0 CA-C-N 119.512 1.051 . . . . 0.0 113.571 172.479 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.26 -21.19 63.67 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.946 2.098 . . . . 0.0 112.516 170.93 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.6 t -148.06 134.59 19.75 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 123.566 1.651 . . . . 0.0 114.152 -170.434 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.8 t -72.43 -55.33 13.52 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.638 0 CA-C-N 112.552 -2.113 . . . . 0.0 108.886 178.017 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 5.9 m -59.2 -40.88 82.21 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 C-N-CA 122.684 0.394 . . . . 0.0 110.029 -179.178 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . 0.452 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 13.3 t -63.78 -37.57 87.88 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.524 1.13 . . . . 0.0 109.713 178.021 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 52.7 m -67.64 -17.11 64.49 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 118.727 -0.654 . . . . 0.0 112.319 175.035 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -86.04 -20.57 55.1 Favored Glycine 0 C--N 1.344 0.991 0 CA-C-N 119.148 0.886 . . . . 0.0 112.205 167.776 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.549 ' CZ ' ' HB3' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -80.21 -43.13 22.0 Favored 'General case' 0 N--CA 1.418 -2.052 0 N-CA-C 113.959 1.096 . . . . 0.0 113.959 -166.269 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -62.27 -17.72 59.31 Favored 'General case' 0 C--N 1.319 -0.752 0 O-C-N 123.975 0.797 . . . . 0.0 110.68 179.916 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 57.8 mttm -71.39 -52.94 15.86 Favored 'General case' 0 C--N 1.345 0.408 0 CA-C-N 118.654 0.661 . . . . 0.0 109.466 167.244 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -62.17 -25.73 67.93 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.013 1.325 . . . . 0.0 112.552 176.526 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.473 ' HG2' ' HE ' ' A' ' 36' ' ' ARG . 15.8 mt-10 -63.69 -35.18 79.71 Favored 'General case' 0 N--CA 1.455 -0.183 0 O-C-N 121.025 -1.047 . . . . 0.0 110.913 173.599 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.8 mm-40 -62.89 -45.7 91.29 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 172.025 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.6 tp10 -58.69 -36.4 74.15 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 112.411 0.522 . . . . 0.0 112.411 175.505 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -72.79 -54.26 9.33 Favored 'General case' 0 N--CA 1.453 -0.28 0 O-C-N 121.468 -0.77 . . . . 0.0 111.164 175.88 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.2 pp -65.97 -32.37 73.82 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 118.796 0.725 . . . . 0.0 111.028 -171.712 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -64.59 -43.14 94.79 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.439 0.563 . . . . 0.0 109.709 172.633 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 75.9 mtm180 -66.25 -35.03 79.36 Favored 'General case' 0 CA--C 1.534 0.331 0 O-C-N 121.245 -0.909 . . . . 0.0 111.051 176.1 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.33 18.0 0.75 Allowed 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.043 1.737 . . . . 0.0 113.866 178.024 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 89.1 p -159.55 -170.12 2.82 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.301 1.441 . . . . 0.0 110.462 -176.557 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.12 87.95 0.16 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.404 1.082 . . . . 0.0 108.643 169.699 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 9.6 m -52.05 102.33 0.05 OUTLIER 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 126.652 1.981 . . . . 0.0 115.604 -168.115 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 43.7 mmtm . . . . . 0 N--CA 1.448 -0.526 0 C-N-CA 125.05 1.34 . . . . 0.0 107.665 167.624 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 73.4 mtm . . . . . 0 CA--C 1.539 0.549 0 CA-C-O 118.658 -0.687 . . . . 0.0 109.583 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -67.61 104.12 0.91 Allowed 'Trans proline' 0 C--N 1.35 0.652 0 C-N-CA 124.099 3.2 . . . . 0.0 111.769 -171.584 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 12.3 mt-30 -145.84 171.99 13.98 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 128.759 2.823 . . . . 0.0 107.444 -176.236 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -63.31 105.7 0.78 Allowed 'General case' 0 C--N 1.341 0.215 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 168.327 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -93.73 99.53 3.61 Favored Pre-proline 0 CA--C 1.539 0.524 0 C-N-CA 125.189 1.396 . . . . 0.0 111.814 -166.33 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -63.85 -28.42 67.51 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 123.646 2.897 . . . . 0.0 112.671 -175.509 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 13.1 m -91.44 -8.1 48.75 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 123.418 0.687 . . . . 0.0 112.145 -176.927 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 20.1 tp60 -63.48 -25.04 68.08 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 119.13 0.877 . . . . 0.0 110.527 -179.514 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -60.04 -52.32 65.89 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.506 1.122 . . . . 0.0 109.589 169.454 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -65.37 -38.71 90.89 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.616 -0.678 . . . . 0.0 110.244 -179.442 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -59.97 -35.4 74.92 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.136 0.974 . . . . 0.0 112.522 172.329 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 95.6 m -65.13 -43.55 91.55 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.229 0.468 . . . . 0.0 110.936 169.207 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 -62.75 -25.54 68.25 Favored 'General case' 0 C--O 1.225 -0.232 0 CA-C-O 117.725 -1.131 . . . . 0.0 112.221 178.367 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 45.2 mm -56.72 -50.3 74.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-N 120.187 1.358 . . . . 0.0 109.439 169.56 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 44.9 mm-40 -60.68 -54.32 46.74 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 -175.729 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 27.0 mttm -70.53 -30.92 67.8 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 118.56 -0.733 . . . . 0.0 111.623 -173.29 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 21.5 t -56.98 -46.0 82.52 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 107.934 -1.136 . . . . 0.0 107.934 168.666 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.0 -43.9 91.58 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-O 118.297 -0.859 . . . . 0.0 110.372 179.722 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -58.51 -46.51 86.6 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 119.475 1.034 . . . . 0.0 111.129 173.07 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.42 -15.28 60.3 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 175.953 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.3 m-80 -122.81 11.05 9.65 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.925 1.29 . . . . 0.0 111.43 -172.931 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.9 m 55.98 40.74 30.36 Favored 'General case' 0 C--N 1.346 0.44 0 CA-C-O 122.556 1.17 . . . . 0.0 110.817 177.315 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . 0.253 6.7 m-85 71.85 12.59 6.17 Favored 'General case' 0 N--CA 1.444 -0.758 0 C-N-CA 128.466 2.706 . . . . 0.0 114.068 169.713 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 62.0 mtm -73.26 83.99 1.38 Allowed 'General case' 0 N--CA 1.437 -1.123 0 C-N-CA 125.445 1.498 . . . . 0.0 109.159 172.214 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -53.46 -24.01 11.68 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.022 0.929 . . . . 0.0 111.465 172.115 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.1 m -51.88 -41.29 61.78 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 126.131 1.773 . . . . 0.0 112.307 169.988 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 56.8 mttt -76.69 -42.5 41.35 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.234 0.614 . . . . 0.0 109.753 175.779 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.8 m -70.98 0.73 6.79 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 124.193 0.997 . . . . 0.0 113.275 -178.7 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 82.3 mm-40 -55.25 -27.44 46.44 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 119.935 1.243 . . . . 0.0 110.823 167.114 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.07 -60.57 3.54 Favored 'General case' 0 C--N 1.345 0.401 0 C-N-CA 125.637 1.575 . . . . 0.0 111.467 171.46 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.6 p -70.93 -29.46 37.38 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.694 0 C-N-CA 123.635 0.774 . . . . 0.0 109.979 -174.437 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.518 HG23 ' CZ ' ' A' ' 53' ' ' PHE . 70.3 mt -58.63 -52.7 56.66 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 N-CA-C 105.869 -1.9 . . . . 0.0 105.869 168.842 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -58.79 -30.07 67.3 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 119.48 1.036 . . . . 0.0 113.187 175.921 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -71.27 -37.67 71.89 Favored 'General case' 0 N--CA 1.438 -1.072 0 C-N-CA 119.833 -0.747 . . . . 0.0 109.724 176.62 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.517 HD13 ' CE1' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -63.42 -30.74 71.82 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 124.811 1.244 . . . . 0.0 108.916 172.289 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.2 mmt85 -70.35 -49.58 47.84 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 -179.952 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 46.1 mttp -61.71 -36.57 81.29 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 124.257 1.023 . . . . 0.0 111.156 177.13 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 42.7 t -60.45 -54.04 50.27 Favored 'General case' 0 C--O 1.221 -0.429 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 169.357 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 51.5 t -61.49 -44.27 97.39 Favored 'General case' 0 CA--C 1.515 -0.379 0 C-N-CA 124.477 1.111 . . . . 0.0 112.202 -169.6 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.45 -3.14 16.31 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.18 -0.918 . . . . 0.0 113.112 -178.354 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.444 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 2.5 tp-100 -88.63 -2.48 58.62 Favored 'General case' 0 N--CA 1.439 -0.999 0 C-N-CA 124.219 1.008 . . . . 0.0 111.361 -175.783 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.444 ' CD1' ' HB3' ' A' ' 41' ' ' GLN . 63.2 m-85 -143.13 162.88 40.83 Favored Pre-proline 0 N--CA 1.443 -0.804 0 C-N-CA 127.364 2.266 . . . . 0.0 110.795 -168.882 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_exo -61.33 116.97 3.74 Favored 'Trans proline' 0 N--CA 1.456 -0.699 0 N-CA-C 105.706 -2.459 . . . . 0.0 105.706 166.231 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -51.84 -35.36 44.31 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 120.498 1.499 . . . . 0.0 114.655 -168.929 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -70.26 -4.61 51.13 Favored Glycine 0 CA--C 1.531 1.089 0 CA-C-O 118.258 -1.301 . . . . 0.0 114.143 178.395 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.97 -7.18 32.78 Favored 'General case' 0 CA--C 1.554 1.104 0 CA-C-N 120.044 1.922 . . . . 0.0 111.86 174.508 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.7 t -141.17 155.32 46.09 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 126.162 1.785 . . . . 0.0 110.404 -168.392 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 47.9 t -79.2 -60.92 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.562 0 C-N-CA 124.876 1.27 . . . . 0.0 108.801 171.197 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.5 m -60.37 -44.31 95.71 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 CA-C-O 119.073 -0.489 . . . . 0.0 110.044 -169.631 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 31.7 t -65.64 -29.39 69.96 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.177 1.391 . . . . 0.0 110.23 -179.737 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 69.6 m -69.68 -21.62 63.5 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 118.533 -0.746 . . . . 0.0 111.307 171.796 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -75.51 -39.23 35.82 Favored Glycine 0 C--N 1.344 1.009 0 CA-C-O 124.474 2.152 . . . . 0.0 110.681 166.976 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.518 ' CZ ' HG23 ' A' ' 32' ' ' ILE . 1.1 t80 -76.69 -38.73 53.94 Favored 'General case' 0 N--CA 1.419 -1.998 0 CA-C-N 111.819 -2.19 . . . . 0.0 116.705 -163.721 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -65.4 -20.09 66.23 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 118.643 -0.694 . . . . 0.0 110.954 169.731 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 42.4 mmtm -72.88 -40.12 65.88 Favored 'General case' 0 C--N 1.347 0.491 0 CA-C-N 119.627 1.103 . . . . 0.0 109.32 167.677 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -55.36 -46.01 76.48 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 118.414 0.552 . . . . 0.0 110.161 170.757 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -60.76 -39.6 89.34 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-O 118.691 -0.671 . . . . 0.0 110.433 176.583 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -60.08 -36.22 76.89 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 119.204 0.911 . . . . 0.0 111.125 175.986 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -63.99 -48.98 74.28 Favored 'General case' 0 C--N 1.343 0.289 0 CA-C-N 118.659 0.663 . . . . 0.0 110.285 169.983 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -64.87 -29.13 70.06 Favored 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 123.756 0.822 . . . . 0.0 111.764 -173.943 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 58.1 mt -61.19 -17.51 53.46 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.832 0.853 . . . . 0.0 112.989 172.895 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 44.1 p -72.17 -49.0 39.21 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 120.05 1.296 . . . . 0.0 110.204 169.886 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 7.7 tmm_? -64.1 -31.07 72.13 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 127.231 2.212 . . . . 0.0 111.463 175.758 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . 0.284 17.9 pttm 48.48 -158.46 0.06 Allowed 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 128.277 2.631 . . . . 0.0 112.534 174.257 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.7 m 66.0 -166.59 0.22 Allowed 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 -167.125 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.64 138.83 57.61 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.774 -0.579 . . . . 0.0 112.052 -176.323 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -167.79 172.1 9.43 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 127.001 2.121 . . . . 0.0 106.686 168.599 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 20.7 ttmm . . . . . 0 N--CA 1.466 0.366 0 C-N-CA 125.572 1.549 . . . . 0.0 111.997 170.746 . . . . . . . . 0 0 . 1 stop_ save_