data_1w6v_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 1w6v _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 ' 7' ' ' ALA . . . . . 0.456 ' HB2' ' CG2' ' A' ' 11' ' ' THR . . . . . . . . 0 N--CA 1.441 -0.876 0 CA-C-O 120.301 0.096 . . . . 0.0 110.877 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.662 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 10.9 t70 -70.2 151.53 45.27 Favored 'General case' 0 CA--C 1.482 -1.658 0 N-CA-C 107.403 -1.332 . . . . 0.0 107.403 173.322 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 19.0 mt -60.25 -38.06 82.32 Favored 'General case' 0 C--N 1.305 -1.334 0 CA-C-O 121.083 0.468 . . . . 0.0 110.887 -175.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -62.14 -31.45 71.93 Favored 'General case' 0 N--CA 1.488 1.473 0 CA-C-N 114.463 -1.244 . . . . 0.0 108.485 -178.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.583 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 3.9 m -80.01 -49.77 11.34 Favored 'General case' 1 N--CA 1.371 -4.395 0 CA-C-N 113.427 -1.715 . . . . 0.0 110.682 178.291 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.662 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 60.0 mt-30 -51.61 -61.54 2.19 Favored 'General case' 0 C--N 1.347 0.487 0 C-N-CA 123.096 0.558 . . . . 0.0 112.085 -174.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.494 ' HA ' ' CH2' ' A' ' 41' ' ' TRP . 6.8 ppt_? -57.74 -38.84 76.04 Favored 'General case' 0 C--O 1.208 -1.109 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -179.255 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.3 t -77.75 -36.8 50.35 Favored 'General case' 0 C--N 1.282 -2.337 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.549 -175.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.452 ' O ' ' HG ' ' A' ' 19' ' ' LEU . 9.8 t70 -70.29 -41.39 73.42 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.464 0.65 . . . . 0.0 109.632 -177.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.517 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 44.7 mm -71.27 -31.89 45.4 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.906 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.306 178.28 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.99 -30.73 71.14 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.978 0.894 . . . . 0.0 108.695 177.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.443 ' HB ' ' O ' ' A' ' 15' ' ' ASP . 1.0 OUTLIER -71.59 -25.96 62.4 Favored 'General case' 0 N--CA 1.4 -2.96 0 CA-C-N 114.198 -1.365 . . . . 0.0 110.488 178.179 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.51 ' HB3' ' CG ' ' A' ' 93' ' ' PRO . 76.6 mt -85.2 -17.54 36.8 Favored 'General case' 0 C--N 1.282 -2.349 0 CA-C-O 121.038 0.447 . . . . 0.0 111.311 -177.268 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 12.3 mt -86.11 -26.71 25.1 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 -179.328 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.434 ' HE2' ' HA ' ' A' ' 18' ' ' THR . 0.0 OUTLIER -91.72 -5.34 53.83 Favored 'General case' 0 N--CA 1.432 -1.333 0 CA-C-N 114.458 -1.246 . . . . 0.0 110.344 177.692 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.403 ' HB ' ' HA ' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -76.43 138.82 40.58 Favored 'General case' 0 N--CA 1.415 -2.182 0 CA-C-N 113.2 -1.818 . . . . 0.0 110.868 178.727 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 71.2 m -57.56 142.96 42.77 Favored 'General case' 0 C--N 1.283 -2.318 0 CA-C-N 113.086 -1.87 . . . . 0.0 111.699 179.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.647 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP 0.296 0.5 OUTLIER -91.33 -27.07 18.62 Favored 'General case' 0 CA--C 1.465 -2.324 0 N-CA-C 116.743 2.127 . . . . 0.0 116.743 -175.315 . . . . . . . . 4 4 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.454 ' O ' HG23 ' A' ' 117' ' ' VAL . 0.0 OUTLIER 63.67 112.01 0.03 OUTLIER 'General case' 0 C--N 1.249 -3.789 0 C-N-CA 127.782 2.433 . . . . 0.0 111.899 179.144 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -60.95 113.04 2.31 Favored 'General case' 0 C--N 1.292 -1.92 0 CA-C-O 121.233 0.539 . . . . 0.0 111.972 -177.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 103.16 7.57 43.3 Favored Glycine 0 N--CA 1.437 -1.29 0 CA-C-N 115.074 -0.966 . . . . 0.0 112.3 -177.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.41 ' HB2' ' HB2' ' A' ' 25' ' ' ARG . 4.8 t70 -87.39 -177.7 6.0 Favored 'General case' 0 C--O 1.248 1.013 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.459 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 40.3 m -126.74 118.06 23.95 Favored 'General case' 0 N--CA 1.424 -1.773 0 CA-C-O 121.427 0.632 . . . . 0.0 110.285 -176.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.647 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 18.2 m95 -107.01 164.72 11.9 Favored 'General case' 0 C--N 1.288 -2.084 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 178.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.428 ' O ' ' HA ' ' A' ' 91' ' ' LEU . 86.7 m-85 -122.43 137.51 54.84 Favored 'General case' 0 C--N 1.278 -2.501 0 N-CA-C 110.329 -0.249 . . . . 0.0 110.329 -178.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.429 ' CD1' ' HB2' ' A' ' 115' ' ' ARG . 9.5 mp -78.74 152.3 31.6 Favored 'General case' 0 C--N 1.309 -1.171 0 C-N-CA 120.275 -0.57 . . . . 0.0 111.626 178.586 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.496 HG11 ' O ' ' A' ' 34' ' ' ASP . 7.2 t -137.75 142.06 37.33 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.624 0 N-CA-C 105.691 -1.966 . . . . 0.0 105.691 172.208 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.496 ' O ' HG11 ' A' ' 33' ' ' VAL . 3.7 p-10 -71.05 141.12 50.9 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 173.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 33.5 p -69.48 -22.21 63.64 Favored 'General case' 0 C--N 1.285 -2.202 0 C-N-CA 120.404 -0.518 . . . . 0.0 111.814 -173.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 90.9 mtt180 -73.37 -40.58 64.25 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.005 -173.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.435 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 71.7 t90 -63.66 -48.05 78.79 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 108.28 -1.008 . . . . 0.0 108.28 178.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.527 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 32.6 t80 -63.29 -43.61 97.38 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-N 114.793 -1.094 . . . . 0.0 110.802 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.41 ' HA ' ' HE2' ' A' ' 42' ' ' LYS . 94.7 mttt -63.02 -34.12 76.88 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 176.698 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.435 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 17.7 tp60 -65.35 -43.87 89.51 Favored 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 172.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.494 ' CH2' ' HA ' ' A' ' 13' ' ' ARG . 65.6 t90 -58.94 -41.97 88.67 Favored 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 114.778 -1.101 . . . . 0.0 110.872 177.609 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.527 ' HG3' ' O ' ' A' ' 38' ' ' PHE . 40.4 mtmt -54.02 -41.89 68.51 Favored 'General case' 0 CA--C 1.507 -0.708 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 179.652 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -63.41 -49.31 74.28 Favored 'General case' 0 CA--C 1.504 -0.819 0 O-C-N 124.111 0.882 . . . . 0.0 109.89 178.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.433 ' HB2' HG21 ' A' ' 60' ' ' VAL . 0.1 OUTLIER -66.08 -41.4 90.73 Favored 'General case' 0 N--CA 1.427 -1.619 0 CA-C-N 114.257 -1.338 . . . . 0.0 112.003 -173.792 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.446 HG13 ' O ' ' A' ' 41' ' ' TRP . 5.7 p -90.36 -21.23 6.71 Favored 'Isoleucine or valine' 0 N--CA 1.395 -3.178 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.513 -174.269 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . 0.476 ' HA3' ' HG3' ' A' ' 52' ' ' LYS . . . 84.78 33.05 19.9 Favored Glycine 0 N--CA 1.418 -2.51 0 C-N-CA 120.32 -0.943 . . . . 0.0 111.162 -175.719 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -74.67 -41.3 60.54 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -88.25 121.36 30.56 Favored 'General case' 0 C--N 1.311 -1.077 0 N-CA-C 107.144 -1.428 . . . . 0.0 107.144 -178.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 31.6 m -60.13 -15.82 26.99 Favored 'General case' 0 C--N 1.297 -1.709 0 N-CA-C 117.323 2.342 . . . . 0.0 117.323 -168.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 63.6 p-90 -104.07 -9.47 18.75 Favored 'General case' 0 N--CA 1.379 -3.986 0 CA-C-N 120.484 1.493 . . . . 0.0 107.67 -177.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -122.13 73.5 1.1 Allowed 'General case' 0 N--CA 1.423 -1.78 0 CA-C-N 114.954 -1.021 . . . . 0.0 109.844 -165.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.476 ' HG3' ' HA3' ' A' ' 46' ' ' GLY . 0.0 OUTLIER -121.5 28.29 7.8 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.179 177.829 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -81.81 -26.34 34.43 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 175.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.474 ' HB3' HG13 ' A' ' 60' ' ' VAL . 11.2 mm100 -97.83 0.94 47.67 Favored 'General case' 0 N--CA 1.413 -2.298 0 CA-C-N 114.35 -1.295 . . . . 0.0 109.995 -178.151 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.3 tmm? -64.95 116.97 6.93 Favored 'General case' 0 N--CA 1.414 -2.252 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.608 -177.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 83.36 3.85 89.77 Favored Glycine 0 N--CA 1.431 -1.692 0 CA-C-N 114.468 -1.242 . . . . 0.0 111.692 -179.193 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.532 ' HB3' HG23 ' A' ' 60' ' ' VAL . 5.5 t0 -82.07 147.1 29.3 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 -176.408 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -84.33 -22.3 30.65 Favored 'General case' 0 C--N 1.296 -1.751 0 CA-C-O 121.347 0.594 . . . . 0.0 110.64 -178.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -60.8 -31.77 71.14 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 121.925 0.869 . . . . 0.0 110.783 -179.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.532 HG23 ' HB3' ' A' ' 57' ' ' ASP . 27.9 m -105.99 8.49 9.66 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.123 0 CA-C-N 114.457 -1.247 . . . . 0.0 111.881 -172.729 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.404 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 0.7 OUTLIER -60.12 119.04 38.51 Favored Pre-proline 0 C--N 1.304 -1.41 0 O-C-N 124.258 0.974 . . . . 0.0 109.349 179.326 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 61' ' ' TYR . 7.5 Cg_endo -88.07 112.9 0.77 Allowed 'Trans proline' 0 N--CA 1.415 -3.113 0 C-N-CA 122.385 2.057 . . . . 0.0 108.905 174.142 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -68.7 -139.47 0.08 OUTLIER Glycine 0 C--N 1.288 -2.138 0 CA-C-N 114.926 -1.034 . . . . 0.0 112.56 176.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.477 ' HA ' ' O ' ' A' ' 104' ' ' TYR . 28.7 Cg_exo -64.32 137.42 55.85 Favored 'Trans proline' 0 C--O 1.248 0.988 0 C-N-CA 122.075 1.85 . . . . 0.0 112.048 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 65.2 mt -60.01 124.15 13.82 Favored 'Isoleucine or valine' 0 C--O 1.242 0.685 0 C-N-CA 123.389 0.676 . . . . 0.0 110.345 -178.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -116.58 104.56 11.53 Favored 'General case' 0 CA--C 1.501 -0.934 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -172.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.606 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 45.6 m-80 -95.0 12.43 28.47 Favored 'General case' 0 C--N 1.295 -1.778 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.567 -176.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 49.6 m -56.55 -34.7 67.35 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -177.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -72.26 -16.15 77.04 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 121.506 -0.378 . . . . 0.0 112.404 178.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 48.0 mt -93.28 -31.52 14.67 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 178.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 67' ' ' ASN . 70.0 mt -76.45 146.02 38.87 Favored 'General case' 0 N--CA 1.433 -1.286 0 CA-C-N 114.65 -1.159 . . . . 0.0 110.646 -176.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 62.8 mttt . . . . . 0 C--N 1.301 -1.501 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 -177.821 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . 0.404 ' CA ' HD12 ' A' ' 71' ' ' LEU . . . . . . . . 0 CA--C 1.508 -0.648 0 CA-C-O 121.925 0.869 . . . . 0.0 110.028 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 6.8 mm100 -117.04 5.58 12.83 Favored 'General case' 0 C--N 1.285 -2.203 0 CA-C-O 122.147 0.975 . . . . 0.0 108.791 -174.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 35.8 m -122.65 125.07 44.88 Favored 'General case' 0 C--N 1.281 -2.381 0 CA-C-N 114.007 -1.451 . . . . 0.0 109.75 -176.538 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.441 ' N ' HD23 ' A' ' 79' ' ' LEU . 2.4 mm? -85.02 151.1 24.42 Favored 'General case' 0 N--CA 1.428 -1.531 0 C-N-CA 123.361 0.664 . . . . 0.0 110.241 178.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.508 ' HB2' ' CD1' ' A' ' 83' ' ' LEU . 99.2 mttt -76.92 168.13 20.62 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-O 121.285 0.564 . . . . 0.0 111.377 176.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -74.25 -45.91 44.86 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 114.678 1.362 . . . . 0.0 114.678 -172.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 26.4 m-70 -81.3 -0.16 39.71 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -167.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.528 ' HB3' ' CE2' ' A' ' 89' ' ' TYR . 8.9 mp -57.3 133.02 54.76 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -179.56 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.471 HD11 HG22 ' A' ' 84' ' ' ILE . 49.5 mt -129.82 174.53 12.46 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.379 0 N-CA-C 104.926 -2.25 . . . . 0.0 104.926 177.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.497 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 62.4 t0 -57.12 -151.82 0.0 OUTLIER 'General case' 0 CA--C 1.594 2.657 0 C-N-CA 126.58 1.952 . . . . 0.0 110.412 179.167 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.717 ' HA ' ' O ' ' A' ' 89' ' ' TYR 0.322 0.0 OUTLIER -39.24 -17.81 0.01 OUTLIER 'General case' 1 N--CA 1.545 4.321 0 N-CA-C 117.884 2.55 . . . . 0.0 117.884 -172.558 . . . . . . . . 5 4 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.41 HD11 HG22 ' A' ' 84' ' ' ILE . 31.5 mt -60.8 -46.26 91.18 Favored 'General case' 0 C--N 1.278 -2.531 0 C-N-CA 124.683 1.193 . . . . 0.0 110.112 171.143 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -114.69 -45.8 2.98 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-O 121.407 0.623 . . . . 0.0 109.452 -178.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' TYR . . . . . 0.717 ' O ' ' HA ' ' A' ' 86' ' ' GLU . 2.0 p90 -138.27 -169.45 2.59 Favored 'General case' 1 C--O 1.139 -4.72 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 -176.114 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.431 HG23 ' N ' ' A' ' 91' ' ' LEU . 8.6 mt -149.05 162.85 4.68 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.903 0 N-CA-C 106.03 -1.841 . . . . 0.0 106.03 173.357 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.431 ' N ' HG23 ' A' ' 90' ' ' ILE . 2.5 mm? -120.12 147.41 44.91 Favored 'General case' 0 N--CA 1.404 -2.77 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 172.841 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -124.38 153.53 69.05 Favored Pre-proline 0 C--N 1.271 -2.811 0 CA-C-N 114.616 -1.175 . . . . 0.0 108.689 171.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.51 ' CG ' ' HB3' ' A' ' 19' ' ' LEU . 5.3 Cg_endo -63.24 168.18 11.44 Favored 'Trans proline' 0 N--CA 1.432 -2.107 0 N-CA-C 107.668 -1.705 . . . . 0.0 107.668 167.063 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 14.7 m -44.36 -48.14 9.72 Favored 'General case' 0 C--N 1.298 -1.652 0 O-C-N 123.743 0.652 . . . . 0.0 110.93 175.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -67.13 -38.92 86.41 Favored 'General case' 0 CA--C 1.472 -2.054 0 CA-C-N 115.052 -0.976 . . . . 0.0 112.086 -177.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.489 ' O ' ' HG ' ' A' ' 100' ' ' LEU . . . -63.86 -51.08 56.54 Favored Glycine 0 N--CA 1.405 -3.37 0 C-N-CA 120.575 -0.821 . . . . 0.0 111.129 -176.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 63.5 t-105 -59.7 -48.98 79.51 Favored 'General case' 0 C--N 1.292 -1.913 0 CA-C-N 114.198 -1.001 . . . . 0.0 110.273 175.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 -51.52 -38.49 54.36 Favored 'General case' 0 C--O 1.195 -1.79 0 O-C-N 123.389 0.43 . . . . 0.0 111.641 176.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 28.3 mttm -66.03 -50.4 64.33 Favored 'General case' 0 CA--C 1.47 -2.109 0 CA-C-O 121.239 0.542 . . . . 0.0 110.308 -179.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.489 ' HG ' ' O ' ' A' ' 96' ' ' GLY . 67.1 mt -67.61 -31.84 72.14 Favored 'General case' 0 C--N 1.275 -2.66 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.765 -176.116 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.446 ' HA ' ' HA ' ' A' ' 105' ' ' THR . 25.0 t -80.28 -24.83 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.398 -3.032 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.017 175.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 20.4 t -78.24 -35.05 48.8 Favored 'General case' 0 C--N 1.299 -1.626 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 178.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' TRP . . . . . 0.478 ' CZ3' ' HB3' ' A' ' 12' ' ' GLN . 34.7 m0 -82.99 -48.87 10.18 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.311 -177.395 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' TYR . . . . . 0.477 ' O ' ' HA ' ' A' ' 64' ' ' PRO . 60.9 m-85 -130.54 6.74 4.82 Favored 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 -173.159 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.446 ' HA ' ' HA ' ' A' ' 101' ' ' VAL 0.27 11.1 t 48.24 -173.27 0.01 OUTLIER 'General case' 0 C--O 1.236 0.389 0 CA-C-O 123.895 1.807 . . . . 0.0 115.13 -179.71 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -105.15 151.81 23.59 Favored 'General case' 1 C--N 1.236 -4.353 0 CA-C-N 112.213 -2.267 . . . . 0.0 105.724 -174.232 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 54.4 mmm -64.14 155.96 29.95 Favored 'General case' 0 CA--C 1.495 -1.146 0 CA-C-O 121.855 0.836 . . . . 0.0 111.627 175.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 20.1 pm0 -75.15 137.88 41.65 Favored 'General case' 0 N--CA 1.389 -3.5 0 CA-C-N 114.346 -1.297 . . . . 0.0 109.289 178.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 89.72 4.12 73.27 Favored Glycine 0 N--CA 1.422 -2.244 0 CA-C-N 114.999 -1.001 . . . . 0.0 112.267 179.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -120.48 169.17 10.58 Favored 'General case' 0 CA--C 1.482 -1.636 0 CA-C-O 121.689 0.756 . . . . 0.0 111.634 -178.45 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -137.76 158.87 70.83 Favored Pre-proline 0 N--CA 1.412 -2.325 0 CA-C-N 114.013 -1.449 . . . . 0.0 107.091 178.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_exo -67.14 134.49 34.15 Favored 'Trans proline' 0 CA--C 1.459 -3.253 0 C-N-CA 122.705 2.27 . . . . 0.0 111.255 175.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 3.7 mp -94.76 107.03 18.87 Favored 'Isoleucine or valine' 1 N--CA 1.377 -4.121 0 CA-C-N 113.654 -1.612 . . . . 0.0 106.97 176.646 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . 0.459 ' HB1' ' CG2' ' A' ' 29' ' ' THR . . . -94.02 128.4 40.36 Favored 'General case' 0 N--CA 1.41 -2.452 0 CA-C-O 121.94 0.876 . . . . 0.0 111.124 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.429 ' HB2' ' CD1' ' A' ' 32' ' ' LEU . 17.0 tpt180 -119.69 120.5 36.8 Favored 'General case' 0 C--N 1.28 -2.43 0 CA-C-N 113.909 -1.496 . . . . 0.0 108.085 -175.682 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -67.81 155.94 38.19 Favored 'General case' 0 N--CA 1.424 -1.741 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 172.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.454 HG23 ' O ' ' A' ' 25' ' ' ARG . 90.8 t . . . . . 0 C--N 1.297 -1.699 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 175.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.341 0 CA-C-O 121.494 0.664 . . . . 0.0 112.484 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.653 ' O ' ' HB ' ' A' ' 11' ' ' THR . 0.6 OUTLIER -62.43 140.07 58.57 Favored 'General case' 0 C--O 1.207 -1.138 0 CA-C-N 114.842 -1.072 . . . . 0.0 108.811 170.298 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.493 ' O ' ' HG3' ' A' ' 13' ' ' ARG . 16.9 mt -61.08 -42.32 98.28 Favored 'General case' 0 CA--C 1.489 -1.4 0 CA-C-O 121.68 0.752 . . . . 0.0 110.77 -174.354 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -64.99 -23.67 67.29 Favored 'General case' 0 C--N 1.292 -1.91 0 CA-C-N 114.424 -1.262 . . . . 0.0 109.464 -177.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.653 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 2.6 m -78.42 -51.65 9.73 Favored 'General case' 0 N--CA 1.389 -3.497 0 CA-C-N 114.722 -1.126 . . . . 0.0 109.761 174.153 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.632 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 52.0 mt-30 -51.58 -53.77 34.57 Favored 'General case' 0 C--N 1.353 0.733 0 C-N-CA 123.528 0.731 . . . . 0.0 111.492 -175.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.493 ' HG3' ' O ' ' A' ' 9' ' ' LEU . 45.1 mtm180 -45.06 -58.21 3.35 Favored 'General case' 0 N--CA 1.486 1.374 0 CA-C-O 121.942 0.877 . . . . 0.0 110.598 177.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 74.3 m -66.68 -45.96 77.19 Favored 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 113.735 -1.575 . . . . 0.0 112.769 -172.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.5 t0 -66.28 -39.57 89.49 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.977 -176.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.566 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 26.2 mm -76.07 -37.88 34.03 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.353 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.268 178.36 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.555 ' O ' ' HG2' ' A' ' 21' ' ' LYS . . . -57.79 -39.87 78.53 Favored 'General case' 0 CA--C 1.495 -1.156 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.419 ' HA ' ' HD3' ' A' ' 21' ' ' LYS . 5.7 m -60.22 -36.28 77.34 Favored 'General case' 0 N--CA 1.396 -3.143 0 CA-C-N 113.372 -1.74 . . . . 0.0 112.015 179.401 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.455 ' HB3' ' CG ' ' A' ' 93' ' ' PRO . 71.8 mt -85.65 -13.33 48.92 Favored 'General case' 0 C--N 1.269 -2.918 0 O-C-N 121.611 -0.68 . . . . 0.0 112.495 -176.755 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 16.2 mt -86.04 -25.25 26.02 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 177.101 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.555 ' HG2' ' O ' ' A' ' 17' ' ' ALA . 19.6 ptmt -91.42 -22.11 20.62 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.596 -176.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 16.4 m -51.06 134.95 25.98 Favored 'General case' 0 N--CA 1.402 -2.839 0 C-N-CA 125.204 1.402 . . . . 0.0 111.639 174.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 72.8 m -77.47 149.59 35.02 Favored 'General case' 0 N--CA 1.395 -3.2 0 CA-C-N 113.529 -1.669 . . . . 0.0 111.649 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -111.44 168.01 9.87 Favored 'General case' 0 N--CA 1.41 -2.44 0 CA-C-N 115.275 -0.875 . . . . 0.0 112.158 178.62 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.4 ' HD3' ' N ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -143.32 152.26 41.44 Favored 'General case' 0 C--N 1.281 -2.393 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 175.743 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -55.08 128.55 34.23 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 121.094 0.474 . . . . 0.0 110.858 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 113.3 -18.3 20.96 Favored Glycine 0 N--CA 1.424 -2.142 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.533 -177.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -72.28 141.15 48.9 Favored 'General case' 0 CA--C 1.498 -1.023 0 CA-C-N 117.288 0.544 . . . . 0.0 110.637 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 49.0 m -97.59 134.34 40.93 Favored 'General case' 0 C--N 1.294 -1.806 0 N-CA-C 107.448 -1.315 . . . . 0.0 107.448 175.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 39.3 m95 -120.12 137.04 54.38 Favored 'General case' 0 C--N 1.282 -2.364 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 67.6 m-85 -98.24 121.66 40.44 Favored 'General case' 0 C--N 1.264 -3.132 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.041 -176.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.767 HD13 ' CD1' ' A' ' 89' ' ' TYR . 15.9 tp -81.07 138.96 35.96 Favored 'General case' 0 N--CA 1.4 -2.933 0 CA-C-N 115.114 -0.948 . . . . 0.0 113.348 -178.588 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.484 HG11 ' O ' ' A' ' 34' ' ' ASP . 58.4 t -132.8 150.67 33.28 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.128 0 C-N-CA 126.126 1.77 . . . . 0.0 107.285 -177.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.497 ' OD2' ' HB2' ' A' ' 36' ' ' ARG . 6.8 t70 -72.16 136.86 46.61 Favored 'General case' 0 C--N 1.284 -2.264 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 169.553 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.418 ' OG ' ' HE3' ' A' ' 39' ' ' LYS . 29.1 t -68.8 -31.58 70.68 Favored 'General case' 0 C--N 1.3 -1.586 0 CA-C-O 121.028 0.442 . . . . 0.0 111.177 -174.804 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.497 ' HB2' ' OD2' ' A' ' 34' ' ' ASP . 55.7 mtt180 -69.66 -34.16 73.61 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.373 -175.073 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.485 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 76.5 t90 -67.5 -45.48 75.69 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 177.405 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -65.18 -39.69 93.24 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.112 -179.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.425 ' HA ' ' HD3' ' A' ' 42' ' ' LYS . 98.4 mttt -64.64 -33.68 76.52 Favored 'General case' 0 CA--C 1.506 -0.723 0 CA-C-O 120.898 0.38 . . . . 0.0 111.511 175.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.485 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 24.5 tp60 -64.42 -44.54 90.92 Favored 'General case' 0 N--CA 1.408 -2.571 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 175.6 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 65.1 t90 -60.76 -43.4 98.04 Favored 'General case' 0 C--O 1.217 -0.633 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.396 176.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.585 ' HG2' ' CD1' ' A' ' 47' ' ' PHE . 15.3 mtpp -57.35 -39.29 75.62 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 123.153 0.581 . . . . 0.0 112.109 -178.204 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 40.3 mttp -72.97 -40.29 65.43 Favored 'General case' 0 C--N 1.285 -2.211 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 177.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.501 ' HB2' HG21 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -68.76 -38.15 79.88 Favored 'General case' 0 C--N 1.289 -2.049 0 CA-C-N 114.861 -1.063 . . . . 0.0 110.142 -176.956 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.429 ' CG1' ' HB2' ' A' ' 47' ' ' PHE . 4.3 p -88.79 -17.84 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.626 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.499 -176.258 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.07 27.96 38.95 Favored Glycine 0 N--CA 1.438 -1.227 0 C-N-CA 120.418 -0.896 . . . . 0.0 112.138 -174.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.585 ' CD1' ' HG2' ' A' ' 42' ' ' LYS . 48.8 t80 -72.73 -38.3 67.46 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 176.171 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.44 ' HB2' ' O ' ' A' ' 51' ' ' ASP . 71.4 m-20 -73.82 111.2 8.74 Favored 'General case' 0 CA--C 1.491 -1.289 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 174.213 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 11.0 m -60.95 -37.23 81.66 Favored 'General case' 0 C--N 1.297 -1.677 0 CA-C-O 121.573 0.701 . . . . 0.0 109.694 178.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 49.2 p90 -81.74 -15.55 53.97 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 114.912 -1.04 . . . . 0.0 111.336 -179.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.44 ' O ' ' HB2' ' A' ' 48' ' ' ASP . 7.6 t70 -141.13 86.87 2.06 Favored 'General case' 0 CA--C 1.475 -1.932 0 CA-C-O 122.364 1.078 . . . . 0.0 110.82 -175.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 63.7 pttt -142.33 18.77 2.07 Favored 'General case' 0 C--N 1.28 -2.427 0 CA-C-N 113.95 -1.477 . . . . 0.0 110.225 -179.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -60.55 -28.43 68.43 Favored 'General case' 0 C--N 1.292 -1.894 0 CA-C-N 112.747 -2.024 . . . . 0.0 107.355 172.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -94.8 11.92 29.82 Favored 'General case' 0 N--CA 1.421 -1.898 0 CA-C-N 113.958 -1.474 . . . . 0.0 111.661 -174.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' MET . . . . . 0.485 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 43.8 ttm -59.46 113.04 1.99 Allowed 'General case' 0 N--CA 1.429 -1.503 0 CA-C-O 121.013 0.435 . . . . 0.0 111.059 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.38 4.78 90.04 Favored Glycine 0 N--CA 1.437 -1.296 0 CA-C-N 115.393 -0.821 . . . . 0.0 112.569 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.475 ' HB3' HG23 ' A' ' 60' ' ' VAL . 4.8 t70 -76.46 148.99 36.86 Favored 'General case' 0 CA--C 1.509 -0.596 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 -176.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -83.7 -14.59 51.34 Favored 'General case' 0 C--N 1.299 -1.592 0 CA-C-O 122.117 0.96 . . . . 0.0 109.618 -178.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 33.2 m-80 -65.34 -25.98 67.83 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.551 175.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.501 HG21 ' HB2' ' A' ' 44' ' ' TYR . 34.1 m -119.9 3.19 6.87 Favored 'Isoleucine or valine' 0 CA--C 1.476 -1.871 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -172.354 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.473 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 5.3 p90 -62.43 118.11 37.36 Favored Pre-proline 0 C--N 1.308 -1.228 0 C-N-CA 119.334 -0.946 . . . . 0.0 109.291 178.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.473 ' HD3' ' HA ' ' A' ' 61' ' ' TYR . 10.1 Cg_endo -88.63 111.04 0.6 Allowed 'Trans proline' 0 N--CA 1.418 -2.936 0 C-N-CA 122.397 2.065 . . . . 0.0 110.088 177.48 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -69.66 -153.9 0.88 Allowed Glycine 0 C--N 1.285 -2.286 0 CA-C-N 115.081 -0.963 . . . . 0.0 112.066 175.249 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.495 ' HB2' ' SD ' ' A' ' 107' ' ' MET . 88.6 Cg_exo -51.38 137.61 47.48 Favored 'Trans proline' 0 C--O 1.252 1.183 0 C-N-CA 122.929 2.419 . . . . 0.0 113.031 -179.721 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.41 HG12 ' CZ2' ' A' ' 37' ' ' TRP . 45.9 mt -64.18 110.51 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.012 0 CA-C-N 114.498 -1.228 . . . . 0.0 111.196 -175.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.452 ' HB2' ' HG3' ' A' ' 107' ' ' MET . 17.5 t70 -104.4 115.64 30.73 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.182 177.371 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -111.53 24.07 13.21 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.778 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 30.2 m -70.59 9.03 0.7 Allowed 'General case' 0 CA--C 1.554 1.133 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 -177.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -109.89 -4.97 29.47 Favored Glycine 0 CA--C 1.496 -1.105 0 C-N-CA 119.14 -1.505 . . . . 0.0 109.782 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.586 ' CD1' ' HB3' ' A' ' 89' ' ' TYR . 2.2 mm? -98.46 -52.99 3.46 Favored 'General case' 0 N--CA 1.418 -2.026 0 CA-C-N 113.482 -1.359 . . . . 0.0 109.797 -176.679 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.497 ' HA ' ' HA ' ' A' ' 79' ' ' LEU . 78.7 mt -59.86 147.13 39.5 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.224 -1.353 . . . . 0.0 113.842 -175.521 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.9 mtpt . . . . . 0 N--CA 1.429 -1.518 0 CA-C-N 113.98 -1.463 . . . . 0.0 108.968 176.319 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.887 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . 0.472 HE22 ' HB2' ' A' ' 111' ' ' GLU . 23.5 mm-40 -125.03 5.46 7.94 Favored 'General case' 0 CA--C 1.478 -1.8 0 N-CA-C 106.601 -1.629 . . . . 0.0 106.601 177.603 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.7 m -131.54 122.16 25.66 Favored 'General case' 0 C--N 1.28 -2.446 0 CA-C-N 112.594 -2.094 . . . . 0.0 109.061 -172.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.549 ' HG ' ' CD2' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -103.64 163.31 12.4 Favored 'General case' 0 N--CA 1.423 -1.814 0 O-C-N 123.451 0.469 . . . . 0.0 109.931 176.023 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.491 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 49.2 mtmt -60.59 116.5 4.4 Favored 'General case' 0 C--N 1.293 -1.85 0 CA-C-O 122.116 0.96 . . . . 0.0 111.802 -177.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -64.39 -8.99 15.22 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 115.027 1.492 . . . . 0.0 115.027 -172.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 46.0 m-70 -98.22 0.29 45.51 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 122.135 -0.353 . . . . 0.0 111.491 178.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 80' ' ' LYS . 56.6 mt -77.09 133.28 39.08 Favored 'General case' 0 C--O 1.248 1.026 0 CA-C-O 121.178 0.513 . . . . 0.0 109.808 179.719 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 49.2 mt -89.0 171.3 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.615 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 178.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.682 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 19.3 t70 -59.64 -139.52 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.971 0 C-N-CA 125.953 1.701 . . . . 0.0 111.041 -179.312 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.595 ' HA ' ' O ' ' A' ' 89' ' ' TYR . 0.1 OUTLIER -41.44 -18.82 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.565 0 N-CA-C 117.231 2.308 . . . . 0.0 117.231 -174.204 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.416 HD22 ' OE2' ' A' ' 86' ' ' GLU . 35.8 mt -60.96 -50.78 72.02 Favored 'General case' 0 C--N 1.292 -1.934 0 CA-C-O 121.57 0.7 . . . . 0.0 109.702 171.588 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -105.51 -45.79 4.35 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.794 -179.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' TYR . . . . . 0.767 ' CD1' HD13 ' A' ' 32' ' ' LEU . 1.5 p90 -139.09 -176.79 4.63 Favored 'General case' 0 C--O 1.161 -3.564 0 CA-C-O 119.323 -0.37 . . . . 0.0 110.703 -175.544 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.415 HG21 ' N ' ' A' ' 91' ' ' LEU . 5.4 mt -143.48 151.53 16.8 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.472 0 CA-C-N 119.493 1.042 . . . . 0.0 109.329 176.334 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.474 HD21 ' HA ' ' A' ' 32' ' ' LEU . 64.2 mt -112.67 133.82 54.5 Favored 'General case' 0 N--CA 1.4 -2.961 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.268 175.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 56.0 mt -121.09 150.77 54.24 Favored Pre-proline 0 C--N 1.281 -2.404 0 CA-C-N 113.744 -1.571 . . . . 0.0 107.366 -178.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.455 ' CG ' ' HB3' ' A' ' 19' ' ' LEU . 72.2 Cg_endo -76.21 169.12 22.66 Favored 'Trans proline' 0 N--CA 1.429 -2.27 0 N-CA-C 107.902 -1.615 . . . . 0.0 107.902 172.508 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 58.1 m -38.25 -54.71 1.39 Allowed 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 123.999 0.92 . . . . 0.0 112.988 177.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -71.56 -32.44 68.11 Favored 'General case' 0 CA--C 1.498 -1.025 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -175.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.417 ' O ' ' HG ' ' A' ' 100' ' ' LEU . . . -59.03 -47.69 89.57 Favored Glycine 0 N--CA 1.436 -1.353 0 N-CA-C 109.99 -1.244 . . . . 0.0 109.99 177.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 69.1 t-105 -67.8 -50.05 58.98 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 123.512 0.725 . . . . 0.0 110.114 178.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -53.3 -31.29 43.26 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 179.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 39.7 mttm -68.39 -55.43 12.0 Favored 'General case' 0 CA--C 1.468 -2.206 0 C-N-CA 123.172 0.589 . . . . 0.0 110.309 176.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.463 HD22 ' CE3' ' A' ' 103' ' ' TRP . 80.9 mt -64.32 -32.83 74.59 Favored 'General case' 0 C--N 1.275 -2.635 0 CA-C-N 114.885 -1.052 . . . . 0.0 112.196 -176.076 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 10.3 t -78.02 -25.87 14.41 Favored 'Isoleucine or valine' 0 N--CA 1.401 -2.89 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.247 175.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 14.7 t -81.38 -33.87 32.03 Favored 'General case' 0 C--N 1.295 -1.787 0 O-C-N 121.425 -0.797 . . . . 0.0 109.086 178.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' TRP . . . . . 0.463 ' CE3' HD22 ' A' ' 100' ' ' LEU . 50.3 m0 -79.93 -45.04 19.25 Favored 'General case' 0 N--CA 1.429 -1.489 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.426 -178.118 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 33.5 m-85 -128.99 -4.05 5.09 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 115.241 1.571 . . . . 0.0 115.241 -174.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . 0.279 7.9 p 58.3 167.28 0.05 OUTLIER 'General case' 0 N--CA 1.42 -1.931 0 N-CA-C 116.211 1.93 . . . . 0.0 116.211 -174.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 30.2 tp -92.4 157.24 16.7 Favored 'General case' 0 C--N 1.281 -2.411 0 CA-C-N 114.09 -1.414 . . . . 0.0 107.438 176.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' MET . . . . . 0.495 ' SD ' ' HB2' ' A' ' 64' ' ' PRO . 62.8 mmm -74.17 156.37 37.39 Favored 'General case' 0 CA--C 1.49 -1.352 0 CA-C-O 121.775 0.798 . . . . 0.0 110.428 174.553 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -89.32 153.56 20.78 Favored 'General case' 0 N--CA 1.394 -3.242 0 CA-C-N 114.32 -1.309 . . . . 0.0 109.2 -179.037 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 101.41 -29.97 11.39 Favored Glycine 0 N--CA 1.415 -2.719 0 C-N-CA 119.873 -1.156 . . . . 0.0 110.965 -176.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -117.14 177.09 4.84 Favored 'General case' 0 N--CA 1.421 -1.904 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . 0.472 ' HB2' HE22 ' A' ' 77' ' ' GLN . 49.1 mt-10 -135.09 160.31 68.77 Favored Pre-proline 0 C--N 1.298 -1.661 0 N-CA-C 106.925 -1.509 . . . . 0.0 106.925 -178.36 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -55.99 122.66 12.16 Favored 'Trans proline' 0 CA--C 1.459 -3.256 0 C-N-CA 122.723 2.282 . . . . 0.0 111.054 177.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 33.8 mt -79.63 105.93 9.9 Favored 'Isoleucine or valine' 1 N--CA 1.379 -4.002 0 CA-C-N 113.05 -1.887 . . . . 0.0 106.957 -179.375 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -98.22 129.97 44.95 Favored 'General case' 0 C--N 1.266 -3.065 0 CA-C-O 121.913 0.863 . . . . 0.0 110.767 -178.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.509 ' HA ' ' NE ' ' A' ' 115' ' ' ARG . 4.0 mmp_? -124.33 -174.47 3.02 Favored 'General case' 0 N--CA 1.395 -3.209 0 N-CA-C 105.111 -2.181 . . . . 0.0 105.111 176.552 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 61.3 pttt -153.01 173.85 14.9 Favored 'General case' 0 C--N 1.254 -3.566 0 C-N-CA 119.822 -0.751 . . . . 0.0 109.658 -177.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 C--N 1.295 -1.791 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 172.613 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.428 ' HB2' ' CG2' ' A' ' 11' ' ' THR . . . . . . . . 0 CA--C 1.506 -0.742 0 CA-C-O 120.652 0.263 . . . . 0.0 110.525 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.654 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 15.0 t70 -67.4 145.47 55.02 Favored 'General case' 0 CA--C 1.483 -1.605 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 175.199 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 38.1 mt -55.07 -41.79 71.96 Favored 'General case' 0 CA--C 1.494 -1.18 0 CA-C-N 119.03 0.832 . . . . 0.0 110.234 -177.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -69.0 -35.9 77.22 Favored 'General case' 0 CA--C 1.494 -1.206 0 CA-C-N 114.461 -1.245 . . . . 0.0 109.989 -177.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.506 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 5.4 m -65.2 -52.37 55.15 Favored 'General case' 0 N--CA 1.389 -3.522 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.028 177.042 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.654 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 79.1 mt-30 -49.31 -54.07 18.84 Favored 'General case' 0 CA--C 1.504 -0.806 0 C-N-CA 124.444 1.097 . . . . 0.0 111.934 -177.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.7 ptt180 -64.01 -43.46 95.55 Favored 'General case' 0 N--CA 1.434 -1.256 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.646 -174.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 44.7 m -69.27 -44.52 71.71 Favored 'General case' 0 C--N 1.288 -2.07 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.244 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -63.81 -37.54 87.75 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.023 0.929 . . . . 0.0 109.962 -175.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.503 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 34.7 mm -78.97 -37.45 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.164 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.299 177.8 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.72 -36.71 77.11 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 -178.146 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 1.3 m -62.48 -32.95 73.93 Favored 'General case' 0 N--CA 1.412 -2.353 0 C-N-CA 124.786 1.234 . . . . 0.0 111.757 177.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 69.0 mt -85.86 -14.01 46.24 Favored 'General case' 0 C--N 1.278 -2.53 0 O-C-N 121.251 -0.906 . . . . 0.0 111.7 -177.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 14.3 mt -84.67 -26.13 27.99 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 177.113 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.39 -13.95 31.51 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-O 122.275 1.036 . . . . 0.0 111.348 -176.859 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 5.6 m -72.33 145.06 48.05 Favored 'General case' 0 N--CA 1.402 -2.869 0 CA-C-N 113.67 -1.604 . . . . 0.0 109.386 173.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.7 t -100.58 161.68 13.44 Favored 'General case' 0 N--CA 1.401 -2.891 0 CA-C-O 121.7 0.762 . . . . 0.0 110.628 -176.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.65 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP . 0.5 OUTLIER -99.46 167.68 10.46 Favored 'General case' 0 C--N 1.294 -1.826 0 CA-C-N 114.57 -1.196 . . . . 0.0 112.829 179.782 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -104.88 -157.45 0.61 Allowed 'General case' 0 C--N 1.291 -1.948 0 N-CA-C 105.939 -1.874 . . . . 0.0 105.939 176.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.505 ' C ' HG22 ' A' ' 117' ' ' VAL . 16.1 ptpt -119.39 29.98 7.35 Favored 'General case' 0 N--CA 1.414 -2.259 0 CA-C-O 121.478 0.656 . . . . 0.0 110.352 172.095 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.472 ' N ' HG22 ' A' ' 117' ' ' VAL . . . -149.78 20.34 1.14 Allowed Glycine 0 CA--C 1.54 1.618 0 CA-C-N 114.831 -1.077 . . . . 0.0 114.165 176.223 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -96.15 -174.48 3.1 Favored 'General case' 0 N--CA 1.491 1.588 0 CA-C-N 118.544 1.172 . . . . 0.0 110.055 -178.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.407 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 90.1 m -133.71 127.44 32.84 Favored 'General case' 0 N--CA 1.425 -1.698 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 170.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.65 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 17.1 m95 -114.33 163.72 14.9 Favored 'General case' 0 C--N 1.277 -2.584 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -123.46 141.87 51.57 Favored 'General case' 0 C--N 1.278 -2.505 0 C-N-CA 121.069 -0.252 . . . . 0.0 111.507 -175.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.579 ' HA ' ' O ' ' A' ' 90' ' ' ILE . 5.5 mp -92.04 134.64 34.63 Favored 'General case' 0 CA--C 1.461 -2.452 0 O-C-N 124.54 1.15 . . . . 0.0 111.512 -179.71 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.428 HG13 ' O ' ' A' ' 34' ' ' ASP . 95.8 t -116.52 142.65 29.21 Favored 'Isoleucine or valine' 0 C--N 1.251 -3.69 0 N-CA-C 102.932 -2.988 . . . . 0.0 102.932 171.853 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.428 ' O ' HG13 ' A' ' 33' ' ' VAL . 10.2 p-10 -72.75 136.7 45.55 Favored 'General case' 0 C--N 1.278 -2.541 0 N-CA-C 106.897 -1.52 . . . . 0.0 106.897 174.004 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 61.9 p -62.3 -28.36 69.68 Favored 'General case' 0 C--N 1.272 -2.802 0 CA-C-N 114.278 -1.328 . . . . 0.0 110.024 -173.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.9 mmt85 -69.96 -45.78 66.67 Favored 'General case' 0 N--CA 1.423 -1.824 0 CA-C-N 114.02 -1.446 . . . . 0.0 110.058 -173.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.514 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 69.1 t90 -67.61 -44.19 78.65 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 179.36 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 38.4 t80 -61.86 -37.83 85.99 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.185 -178.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -73.78 -23.66 59.73 Favored 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 121.693 -0.629 . . . . 0.0 112.627 178.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.514 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 24.5 tp60 -70.29 -42.61 71.84 Favored 'General case' 0 N--CA 1.412 -2.341 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 172.114 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.431 ' O ' HG21 ' A' ' 45' ' ' VAL . 78.4 t90 -62.31 -39.39 92.88 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-N 114.241 -1.345 . . . . 0.0 110.529 176.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.522 ' HG2' ' CD2' ' A' ' 47' ' ' PHE . 11.5 mtpp -55.57 -46.77 77.16 Favored 'General case' 0 CA--C 1.498 -1.032 0 C-N-CA 123.265 0.626 . . . . 0.0 111.683 178.475 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -57.66 -52.5 65.19 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 124.766 1.291 . . . . 0.0 110.727 178.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.507 ' HB2' HG21 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -60.61 -36.42 78.56 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 113.594 -1.639 . . . . 0.0 114.226 -175.241 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.431 HG21 ' O ' ' A' ' 41' ' ' TRP . 18.8 m -95.95 -17.26 6.99 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.781 0 N-CA-C 113.234 0.827 . . . . 0.0 113.234 -178.842 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . 0.516 ' HA3' ' CB ' ' A' ' 52' ' ' LYS . . . 79.79 38.12 20.92 Favored Glycine 0 N--CA 1.4 -3.743 0 C-N-CA 119.949 -1.12 . . . . 0.0 110.967 -172.698 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.522 ' CD2' ' HG2' ' A' ' 42' ' ' LYS . 75.9 t80 -63.22 -40.43 97.44 Favored 'General case' 0 N--CA 1.442 -0.827 0 C-N-CA 123.022 0.529 . . . . 0.0 111.562 -176.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.495 ' HB3' ' HB3' ' A' ' 51' ' ' ASP . 3.5 t70 -92.3 -178.95 5.09 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 -174.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' SER . . . . . 0.462 ' O ' ' HE2' ' A' ' 52' ' ' LYS . 20.8 m -84.94 -37.17 20.85 Favored 'General case' 0 C--N 1.294 -1.822 0 N-CA-C 111.755 0.279 . . . . 0.0 111.755 -176.696 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 66.7 p-90 -105.13 -21.14 13.32 Favored 'General case' 0 N--CA 1.39 -3.471 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 -178.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.495 ' HB3' ' HB3' ' A' ' 48' ' ' ASP . 31.7 t0 -94.98 73.29 3.46 Favored 'General case' 0 CA--C 1.461 -2.449 0 CA-C-N 114.071 -1.422 . . . . 0.0 108.776 -170.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.516 ' CB ' ' HA3' ' A' ' 46' ' ' GLY . 65.2 pttt -162.39 9.68 0.06 Allowed 'General case' 0 N--CA 1.415 -2.192 0 CA-C-N 112.689 -2.051 . . . . 0.0 114.058 -174.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -63.53 -22.9 67.15 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-O 122.639 1.209 . . . . 0.0 108.101 171.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.462 ' HB3' HG13 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -94.48 11.34 31.13 Favored 'General case' 0 N--CA 1.427 -1.594 0 CA-C-N 113.426 -1.715 . . . . 0.0 110.858 -175.817 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 46.5 ttm -62.11 115.13 3.85 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 110.067 -0.345 . . . . 0.0 110.067 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.03 20.55 77.5 Favored Glycine 0 N--CA 1.44 -1.094 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.824 -179.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.507 ' HB3' HG23 ' A' ' 60' ' ' VAL . 5.7 t0 -91.83 147.6 22.86 Favored 'General case' 0 CA--C 1.503 -0.846 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 -179.302 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.445 ' O ' ' HD2' ' A' ' 61' ' ' TYR . 19.4 pt20 -83.21 -17.56 42.35 Favored 'General case' 0 C--N 1.296 -1.72 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 -62.39 -25.26 67.83 Favored 'General case' 0 CA--C 1.492 -1.27 0 CA-C-N 115.043 -0.981 . . . . 0.0 111.41 177.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.507 HG21 ' HB2' ' A' ' 44' ' ' TYR . 26.5 m -121.19 7.44 6.07 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.824 0 CA-C-N 115.028 -0.987 . . . . 0.0 112.099 -172.401 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.445 ' HD2' ' O ' ' A' ' 58' ' ' GLN . 0.9 OUTLIER -62.73 116.53 24.41 Favored Pre-proline 0 C--N 1.305 -1.342 0 O-C-N 124.052 0.845 . . . . 0.0 111.067 -178.419 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 61' ' ' TYR . 15.0 Cg_endo -89.78 117.97 0.75 Allowed 'Trans proline' 0 N--CA 1.41 -3.399 0 C-N-CA 122.699 2.266 . . . . 0.0 111.422 177.555 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -73.45 -153.67 2.64 Favored Glycine 0 C--N 1.273 -2.95 0 CA-C-N 113.806 -1.543 . . . . 0.0 111.253 171.046 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.83 143.06 82.76 Favored 'Trans proline' 0 C--O 1.245 0.859 0 C-N-CA 122.82 2.347 . . . . 0.0 112.662 -178.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 42.2 mt -64.95 114.07 2.3 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.115 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.82 -176.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.459 ' HB2' ' HG3' ' A' ' 107' ' ' MET . 24.4 t70 -113.35 104.96 12.83 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 116.022 -0.535 . . . . 0.0 109.769 178.687 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -91.22 19.51 5.84 Favored 'General case' 0 C--N 1.303 -1.419 0 CA-C-N 116.925 -0.125 . . . . 0.0 111.245 -176.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 33.2 t -54.75 -31.66 58.8 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -176.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -66.06 -18.25 66.62 Favored Glycine 0 CA--C 1.527 0.79 0 C-N-CA 121.296 -0.478 . . . . 0.0 113.446 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 32.1 mt -93.61 -21.61 19.3 Favored 'General case' 0 C--O 1.247 0.928 0 CA-C-O 121.395 0.617 . . . . 0.0 109.388 179.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.478 HD12 ' HA ' ' A' ' 76' ' ' ALA . 50.3 mt -79.87 137.6 36.97 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.713 -173.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt . . . . . 0 C--O 1.246 0.891 0 CA-C-O 122.264 1.031 . . . . 0.0 111.135 178.24 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . 0.478 ' HA ' HD12 ' A' ' 71' ' ' LEU . . . . . . . . 0 N--CA 1.438 -1.035 0 CA-C-O 121.939 0.876 . . . . 0.0 109.629 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 23.2 mm-40 -114.94 3.13 14.45 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.238 178.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 94.7 p -98.13 113.04 24.81 Favored 'General case' 0 C--N 1.297 -1.683 0 CA-C-N 115.164 -0.926 . . . . 0.0 111.343 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -93.68 141.87 28.0 Favored 'General case' 0 N--CA 1.425 -1.705 0 C-N-CA 123.867 0.867 . . . . 0.0 111.459 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -61.69 139.27 58.32 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.318 0.58 . . . . 0.0 111.163 175.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.48 ' CD ' ' H ' ' A' ' 81' ' ' GLU . 0.4 OUTLIER -58.56 -48.07 82.11 Favored 'General case' 0 C--N 1.301 -1.501 0 C-N-CA 124.838 1.255 . . . . 0.0 110.139 -176.445 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 71.9 m80 -84.85 12.06 8.11 Favored 'General case' 0 C--N 1.295 -1.793 0 CA-C-N 113.971 -1.468 . . . . 0.0 114.053 -170.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 74.9 mt -60.49 119.59 8.32 Favored 'General case' 0 C--O 1.24 0.604 0 CA-C-O 120.879 0.371 . . . . 0.0 111.965 178.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.516 ' O ' ' HB2' ' A' ' 88' ' ' ASP . 51.2 mt -98.89 171.78 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.434 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 173.514 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.6 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 24.0 t70 -62.87 -139.08 0.0 OUTLIER 'General case' 0 C--O 1.185 -2.292 0 C-N-CA 125.183 1.393 . . . . 0.0 111.497 -177.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.675 ' HA ' ' O ' ' A' ' 89' ' ' TYR 0.271 1.0 OUTLIER -40.72 -20.54 0.01 OUTLIER 'General case' 0 N--CA 1.535 3.799 0 N-CA-C 117.018 2.229 . . . . 0.0 117.018 -173.192 . . . . . . . . 4 4 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.509 HD11 ' CG2' ' A' ' 84' ' ' ILE . 66.1 mt -60.81 -57.98 10.37 Favored 'General case' 0 C--N 1.281 -2.39 0 C-N-CA 124.124 0.97 . . . . 0.0 109.645 171.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.516 ' HB2' ' O ' ' A' ' 84' ' ' ILE . 10.2 m-20 -97.86 -49.21 4.89 Favored 'General case' 0 CA--C 1.491 -1.295 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.06 -178.659 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' TYR . . . . . 0.675 ' O ' ' HA ' ' A' ' 86' ' ' GLU . 5.4 p90 -135.39 -165.87 1.75 Allowed 'General case' 0 C--O 1.16 -3.62 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 -175.214 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.579 ' O ' ' HA ' ' A' ' 32' ' ' LEU . 9.0 mt -147.05 149.75 15.4 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.316 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 169.261 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.411 HD23 ' CD1' ' A' ' 32' ' ' LEU . 37.2 mt -118.56 122.16 41.96 Favored 'General case' 0 N--CA 1.412 -2.34 0 O-C-N 124.453 1.096 . . . . 0.0 112.432 178.548 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.437 ' N ' HD13 ' A' ' 92' ' ' LEU . 1.7 mp -129.88 157.56 76.44 Favored Pre-proline 0 C--N 1.3 -1.546 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 -178.35 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -63.77 169.56 9.95 Favored 'Trans proline' 0 CA--C 1.5 -1.204 0 C-N-CA 122.442 2.095 . . . . 0.0 110.243 176.205 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 18.5 m -36.71 -56.4 0.84 Allowed 'General case' 0 C--N 1.322 -0.601 0 O-C-N 124.611 1.194 . . . . 0.0 110.738 170.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -59.2 -36.86 76.11 Favored 'General case' 0 C--O 1.199 -1.575 0 C-N-CA 124.812 1.245 . . . . 0.0 112.392 -174.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.561 ' O ' HD23 ' A' ' 100' ' ' LEU . . . -59.02 -62.74 5.88 Favored Glycine 0 N--CA 1.423 -2.23 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 179.363 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 68.8 t-105 -52.69 -49.79 64.6 Favored 'General case' 0 C--N 1.315 -0.893 0 C-N-CA 124.717 1.207 . . . . 0.0 110.488 177.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.463 ' O ' ' HB2' ' A' ' 102' ' ' SER . 34.4 t30 -53.49 -31.49 46.13 Favored 'General case' 0 N--CA 1.419 -2.014 0 C-N-CA 126.787 2.035 . . . . 0.0 111.962 178.339 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 52.7 mttm -78.22 -49.57 13.51 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-N 118.103 0.41 . . . . 0.0 110.402 174.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.561 HD23 ' O ' ' A' ' 96' ' ' GLY . 1.0 OUTLIER -57.4 -42.72 82.79 Favored 'General case' 0 C--O 1.24 0.567 0 CA-C-O 121.476 0.655 . . . . 0.0 111.362 -179.484 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 49.1 t -71.66 -27.99 29.79 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.809 0 C-N-CA 123.768 0.827 . . . . 0.0 111.091 177.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' SER . . . . . 0.463 ' HB2' ' O ' ' A' ' 98' ' ' ASN . 22.7 t -71.23 -34.08 70.46 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 178.65 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' TRP . . . . . 0.413 ' CH2' ' HA ' ' A' ' 12' ' ' GLN . 41.1 m0 -83.96 -54.0 5.17 Favored 'General case' 0 N--CA 1.423 -1.811 0 CA-C-N 115.266 -0.879 . . . . 0.0 112.239 -175.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -127.51 10.72 6.73 Favored 'General case' 0 CA--C 1.502 -0.88 0 N-CA-C 114.359 1.244 . . . . 0.0 114.359 -173.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 24.8 p 56.64 172.0 0.04 OUTLIER 'General case' 0 N--CA 1.411 -2.385 0 N-CA-C 116.774 2.139 . . . . 0.0 116.774 178.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.07 153.37 17.68 Favored 'General case' 0 C--N 1.282 -2.337 0 N-CA-C 105.831 -1.914 . . . . 0.0 105.831 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' MET . . . . . 0.459 ' HG3' ' HB2' ' A' ' 66' ' ' ASP . 65.3 mmm -64.62 156.17 30.94 Favored 'General case' 0 CA--C 1.493 -1.225 0 CA-C-O 121.299 0.571 . . . . 0.0 110.348 173.418 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -74.78 149.03 39.86 Favored 'General case' 0 N--CA 1.407 -2.609 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.043 -179.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 83.47 -34.55 2.89 Favored Glycine 0 N--CA 1.423 -2.183 0 CA-C-N 115.251 -0.886 . . . . 0.0 112.109 -178.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -79.0 150.67 31.89 Favored 'General case' 0 N--CA 1.411 -2.395 0 CA-C-O 121.302 0.573 . . . . 0.0 111.116 179.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -133.01 146.42 61.19 Favored Pre-proline 0 N--CA 1.406 -2.646 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -48.63 128.39 18.17 Favored 'Trans proline' 0 CA--C 1.467 -2.825 0 C-N-CA 124.097 3.198 . . . . 0.0 114.544 -174.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.422 HG21 HD12 ' A' ' 32' ' ' LEU . 45.9 mt -85.21 107.47 16.08 Favored 'Isoleucine or valine' 1 N--CA 1.371 -4.384 0 CA-C-N 113.28 -1.782 . . . . 0.0 106.879 175.809 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . 0.407 ' HB1' ' CG2' ' A' ' 29' ' ' THR . . . -103.86 135.64 45.03 Favored 'General case' 0 C--N 1.275 -2.656 0 CA-C-O 121.446 0.641 . . . . 0.0 110.823 -178.491 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.511 ' CB ' HD13 ' A' ' 32' ' ' LEU . 13.2 tpt180 -136.25 126.97 27.26 Favored 'General case' 0 CA--C 1.455 -2.697 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 179.151 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.84 -176.27 3.82 Favored 'General case' 0 C--N 1.253 -3.622 0 CA-C-O 123.358 1.552 . . . . 0.0 112.125 179.186 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.505 HG22 ' C ' ' A' ' 26' ' ' LYS . 9.0 m . . . . . 1 N--CA 1.371 -4.394 0 CA-C-N 111.249 -2.705 . . . . 0.0 111.77 172.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.451 ' HB2' ' CG2' ' A' ' 11' ' ' THR . . . . . . . . 0 N--CA 1.422 -1.844 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.585 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 23.3 t70 -69.02 151.35 46.6 Favored 'General case' 0 C--O 1.194 -1.847 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 174.825 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -41.05 -52.49 3.18 Favored 'General case' 0 C--N 1.307 -1.258 0 C-N-CA 126.263 1.825 . . . . 0.0 112.447 177.373 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -68.91 -31.02 69.62 Favored 'General case' 0 C--N 1.271 -2.808 0 CA-C-N 113.593 -1.639 . . . . 0.0 110.221 -175.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.573 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 16.5 m -73.65 -44.3 57.18 Favored 'General case' 1 N--CA 1.377 -4.098 0 CA-C-N 114.57 -1.196 . . . . 0.0 110.786 177.847 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.585 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 45.9 mt-30 -56.78 -57.27 13.17 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 122.651 0.38 . . . . 0.0 111.589 -173.512 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.95 -41.37 64.44 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-O 121.151 0.501 . . . . 0.0 112.165 177.029 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.5 m -69.72 -47.16 64.09 Favored 'General case' 0 C--N 1.291 -1.965 0 CA-C-N 115.668 -0.697 . . . . 0.0 111.572 -178.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.554 ' O ' ' HB ' ' A' ' 18' ' ' THR . 13.5 t70 -61.31 -43.75 98.36 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 124.487 1.115 . . . . 0.0 110.64 -178.079 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.572 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 32.0 mm -72.88 -37.26 54.0 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.998 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.055 -178.375 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.454 ' O ' ' HG3' ' A' ' 21' ' ' LYS . . . -61.6 -36.99 82.27 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.554 ' HB ' ' O ' ' A' ' 15' ' ' ASP . 6.3 m -62.15 -33.99 75.55 Favored 'General case' 0 N--CA 1.408 -2.549 0 C-N-CA 125.898 1.679 . . . . 0.0 111.741 178.314 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 73.5 mt -85.79 -13.95 46.64 Favored 'General case' 0 C--N 1.27 -2.875 0 O-C-N 121.258 -0.901 . . . . 0.0 111.886 -177.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 14.3 mt -86.33 -26.88 24.64 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.611 0.72 . . . . 0.0 109.485 177.376 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.454 ' HG3' ' O ' ' A' ' 17' ' ' ALA . 0.1 OUTLIER -89.36 -7.66 54.81 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-O 122.35 1.071 . . . . 0.0 111.659 -174.507 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 15.2 m -75.73 136.71 40.32 Favored 'General case' 0 N--CA 1.386 -3.625 0 CA-C-N 113.207 -1.815 . . . . 0.0 110.729 176.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.5 m -75.03 142.86 43.75 Favored 'General case' 0 N--CA 1.403 -2.809 0 CA-C-N 113.724 -1.58 . . . . 0.0 111.549 178.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.519 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP . 0.5 OUTLIER -98.52 179.56 4.66 Favored 'General case' 0 N--CA 1.423 -1.812 0 N-CA-C 114.228 1.196 . . . . 0.0 114.228 -178.312 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.564 ' O ' HG23 ' A' ' 117' ' ' VAL . 3.6 mmp_? -127.23 -145.52 0.32 Allowed 'General case' 0 C--O 1.203 -1.383 0 C-N-CA 123.466 0.706 . . . . 0.0 110.894 -172.694 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -119.24 122.46 41.99 Favored 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 171.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 68.23 36.53 85.17 Favored Glycine 0 C--O 1.224 -0.493 0 N-CA-C 110.857 -0.897 . . . . 0.0 110.857 -177.086 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.415 ' HB2' ' HB2' ' A' ' 25' ' ' ARG . 34.1 t70 -79.23 -8.68 59.22 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-O 121.786 0.803 . . . . 0.0 111.989 -174.509 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.429 ' HA ' ' HA ' ' A' ' 116' ' ' LYS . 25.9 m 49.55 110.2 0.0 OUTLIER 'General case' 0 C--N 1.282 -2.344 0 C-N-CA 127.159 2.184 . . . . 0.0 114.369 -176.147 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.519 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 13.1 m95 -114.25 134.62 54.81 Favored 'General case' 0 C--N 1.3 -1.564 0 CA-C-N 114.693 -1.14 . . . . 0.0 109.172 -178.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -104.44 147.96 26.97 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 111.367 0.136 . . . . 0.0 111.367 -174.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.687 ' HA ' ' O ' ' A' ' 90' ' ' ILE . 5.8 mp -93.24 144.85 24.9 Favored 'General case' 0 CA--C 1.491 -1.307 0 N-CA-C 114.328 1.232 . . . . 0.0 114.328 -175.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 75.4 t -131.11 140.94 47.34 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.715 0 N-CA-C 105.871 -1.9 . . . . 0.0 105.871 173.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.409 ' HA ' HD13 ' A' ' 70' ' ' LEU . 20.1 t0 -64.62 131.61 47.47 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 173.689 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.487 ' O ' ' HE3' ' A' ' 39' ' ' LYS . 47.6 t -59.79 -37.54 79.39 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.262 -176.347 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 88.5 mtm180 -68.48 -34.31 75.71 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.848 -174.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.477 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 65.3 t90 -66.11 -46.37 77.84 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 177.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.52 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 32.7 t80 -64.7 -41.63 95.88 Favored 'General case' 0 C--O 1.206 -1.187 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.135 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.491 ' HG3' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.27 -38.98 69.28 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 118.394 0.543 . . . . 0.0 111.868 173.394 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.477 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 22.9 tp60 -65.58 -41.85 92.43 Favored 'General case' 0 N--CA 1.421 -1.906 0 CA-C-O 121.279 0.562 . . . . 0.0 109.854 175.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 77.1 t90 -63.09 -39.68 95.43 Favored 'General case' 0 N--CA 1.437 -1.097 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.001 178.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.52 ' HG3' ' O ' ' A' ' 38' ' ' PHE . 35.8 mtmt -57.65 -40.08 78.48 Favored 'General case' 0 CA--C 1.515 -0.396 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 178.518 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -61.24 -48.63 80.57 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.884 0.849 . . . . 0.0 109.862 176.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.572 ' O ' ' HA ' ' A' ' 55' ' ' MET . 2.1 t80 -66.48 -41.92 88.22 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 113.548 -1.66 . . . . 0.0 112.709 -175.458 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.439 ' CG1' ' HB2' ' A' ' 47' ' ' PHE . 1.6 p -90.54 -15.99 8.37 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.05 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.789 -173.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . 0.466 ' HA3' ' HB2' ' A' ' 52' ' ' LYS . . . 75.83 33.18 51.79 Favored Glycine 0 N--CA 1.416 -2.639 0 C-N-CA 121.249 -0.5 . . . . 0.0 112.119 -176.468 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.439 ' HB2' ' CG1' ' A' ' 45' ' ' VAL . 54.4 t80 -68.36 -45.48 72.68 Favored 'General case' 0 N--CA 1.44 -0.973 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.458 ' O ' ' HB3' ' A' ' 52' ' ' LYS . 70.2 m-20 -78.81 116.29 19.05 Favored 'General case' 0 CA--C 1.491 -1.29 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 178.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 36.0 m -66.63 -27.84 68.0 Favored 'General case' 0 C--N 1.291 -1.963 0 N-CA-C 111.8 0.296 . . . . 0.0 111.8 -178.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 45.0 p90 -82.57 -14.39 54.94 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.59 -178.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -154.53 101.06 2.31 Favored 'General case' 0 CA--C 1.488 -1.413 0 CA-C-O 121.417 0.627 . . . . 0.0 110.21 -179.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.466 ' HB2' ' HA3' ' A' ' 46' ' ' GLY . 22.8 pttp -156.91 21.41 0.32 Allowed 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 114.66 -1.154 . . . . 0.0 111.748 -171.387 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -70.79 -4.09 22.19 Favored 'General case' 0 C--N 1.266 -3.046 0 CA-C-N 114.503 -1.226 . . . . 0.0 110.177 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -106.87 11.71 29.71 Favored 'General case' 0 N--CA 1.403 -2.779 0 C-N-CA 124.467 1.107 . . . . 0.0 109.167 -177.3 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' MET . . . . . 0.572 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 50.0 ttm -60.98 103.56 0.28 Allowed 'General case' 0 N--CA 1.428 -1.555 0 C-N-CA 123.837 0.855 . . . . 0.0 110.914 179.56 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 89.54 15.69 58.04 Favored Glycine 0 N--CA 1.439 -1.117 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.873 -178.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.533 ' HB3' HG23 ' A' ' 60' ' ' VAL . 29.3 t0 -89.89 142.89 27.27 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 179.7 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -82.82 -16.25 48.48 Favored 'General case' 0 C--N 1.296 -1.72 0 CA-C-O 122.358 1.075 . . . . 0.0 109.061 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 66.3 m-20 -62.51 -26.3 68.47 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 114.317 -1.311 . . . . 0.0 111.171 175.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.533 HG23 ' HB3' ' A' ' 57' ' ' ASP . 27.3 m -123.33 1.95 5.78 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.693 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.113 -172.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -66.37 119.56 63.35 Favored Pre-proline 0 C--N 1.299 -1.594 0 C-N-CA 119.426 -0.91 . . . . 0.0 110.495 -178.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -87.22 117.07 1.25 Allowed 'Trans proline' 0 N--CA 1.413 -3.257 0 C-N-CA 122.529 2.153 . . . . 0.0 110.22 177.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -71.47 -145.35 0.41 Allowed Glycine 0 C--N 1.267 -3.26 0 CA-C-N 113.875 -1.511 . . . . 0.0 112.779 177.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -54.62 135.71 67.86 Favored 'Trans proline' 0 C--O 1.253 1.27 0 C-N-CA 123.001 2.468 . . . . 0.0 112.822 -177.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.44 HD13 ' HB3' ' A' ' 100' ' ' LEU . 57.2 mt -70.04 107.18 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.927 0 CA-C-N 115.133 -0.94 . . . . 0.0 112.029 -176.402 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -95.97 128.4 42.83 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.115 175.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.512 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 35.1 m-80 -124.21 11.82 8.83 Favored 'General case' 0 C--N 1.315 -0.933 0 O-C-N 123.96 0.787 . . . . 0.0 110.412 -179.006 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 23.0 t -59.95 -30.16 68.89 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -173.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -76.09 -13.28 83.37 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 121.479 -0.391 . . . . 0.0 112.547 -178.271 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.409 HD13 ' HA ' ' A' ' 34' ' ' ASP . 37.4 mt -91.08 -20.48 22.01 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.515 ' O ' ' HE2' ' A' ' 80' ' ' LYS . 44.9 mt -83.96 159.11 21.32 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.237 -170.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.439 ' HG3' ' C ' ' A' ' 79' ' ' LEU . 58.1 mtpt . . . . . 0 C--N 1.311 -1.081 0 CA-C-O 121.804 0.811 . . . . 0.0 111.797 178.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.721 0 CA-C-O 122.151 0.977 . . . . 0.0 109.509 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -112.68 2.85 16.29 Favored 'General case' 0 C--N 1.303 -1.44 0 CA-C-O 122.242 1.02 . . . . 0.0 108.506 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.2 t -113.56 140.68 47.96 Favored 'General case' 0 C--N 1.287 -2.12 0 N-CA-C 106.364 -1.717 . . . . 0.0 106.364 177.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.459 ' HA ' ' HA ' ' A' ' 71' ' ' LEU . 1.0 OUTLIER -126.41 153.84 44.44 Favored 'General case' 0 N--CA 1.409 -2.495 0 C-N-CA 120.719 -0.392 . . . . 0.0 110.391 -174.49 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.515 ' HE2' ' O ' ' A' ' 71' ' ' LEU . 66.2 mttm -55.25 144.23 25.34 Favored 'General case' 0 C--N 1.31 -1.144 0 N-CA-C 116.055 1.872 . . . . 0.0 116.055 -171.683 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -48.02 -58.24 4.71 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 127.218 2.207 . . . . 0.0 115.847 -172.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 41.4 m80 -91.84 -1.76 57.19 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 113.882 1.067 . . . . 0.0 113.882 -169.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.42 ' HB3' ' CD2' ' A' ' 89' ' ' TYR . 10.7 mp -59.98 127.5 32.21 Favored 'General case' 0 C--O 1.254 1.303 0 N-CA-C 115.307 1.595 . . . . 0.0 115.307 -176.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.411 HD12 HG22 ' A' ' 84' ' ' ILE . 61.8 mt -97.74 174.01 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 CA-C-N 112.67 -2.059 . . . . 0.0 107.029 177.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.555 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 18.3 t70 -61.59 -139.98 0.0 OUTLIER 'General case' 0 CA--C 1.581 2.173 0 C-N-CA 126.071 1.749 . . . . 0.0 110.684 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.615 ' HA ' ' O ' ' A' ' 89' ' ' TYR 0.252 0.2 OUTLIER -40.33 -18.86 0.01 OUTLIER 'General case' 0 N--CA 1.517 2.875 0 C-N-CA 127.333 2.253 . . . . 0.0 116.65 -171.811 . . . . . . . . 4 4 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 54.7 mt -65.18 -59.15 4.41 Favored 'General case' 0 C--N 1.274 -2.678 0 C-N-CA 124.638 1.175 . . . . 0.0 110.847 172.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 36.4 m-20 -97.12 -39.18 9.43 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.709 -175.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' TYR . . . . . 0.615 ' O ' ' HA ' ' A' ' 86' ' ' GLU . 2.6 p90 -145.05 -164.34 1.91 Allowed 'General case' 0 C--O 1.162 -3.511 0 N-CA-C 105.172 -2.158 . . . . 0.0 105.172 -177.344 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.687 ' O ' ' HA ' ' A' ' 32' ' ' LEU . 3.1 mt -144.85 150.94 15.72 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.313 0 CA-C-N 120.25 1.386 . . . . 0.0 108.767 171.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.451 HD23 ' CD1' ' A' ' 32' ' ' LEU . 26.4 mt -119.98 117.98 29.47 Favored 'General case' 0 N--CA 1.393 -3.286 0 O-C-N 124.444 1.09 . . . . 0.0 110.936 175.829 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.472 ' HB3' ' HA2' ' A' ' 96' ' ' GLY . 1.2 mm? -111.95 161.14 27.15 Favored Pre-proline 0 CA--C 1.487 -1.48 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 177.334 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -59.78 168.22 5.87 Favored 'Trans proline' 0 C--O 1.257 1.432 0 C-N-CA 121.886 1.724 . . . . 0.0 108.158 165.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 34.1 m -50.89 -40.48 56.79 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 177.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -57.12 -52.71 64.19 Favored 'General case' 0 C--O 1.198 -1.635 0 C-N-CA 124.021 0.929 . . . . 0.0 111.522 177.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.528 ' O ' HD23 ' A' ' 100' ' ' LEU . . . -54.23 -57.61 16.2 Favored Glycine 0 CA--C 1.495 -1.211 0 O-C-N 124.049 0.843 . . . . 0.0 112.082 -175.033 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 47.8 t-105 -53.66 -51.02 64.49 Favored 'General case' 0 C--N 1.289 -2.027 0 C-N-CA 123.512 0.725 . . . . 0.0 111.287 174.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -55.03 -28.79 54.9 Favored 'General case' 0 C--O 1.195 -1.782 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 175.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.635 ' HB3' ' CH2' ' A' ' 103' ' ' TRP . 19.0 mmtp -69.76 -57.14 5.47 Favored 'General case' 0 N--CA 1.41 -2.465 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 177.257 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.528 HD23 ' O ' ' A' ' 96' ' ' GLY . 0.5 OUTLIER -58.88 -39.22 80.74 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.918 -176.94 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.519 ' O ' ' HA ' ' A' ' 105' ' ' THR . 55.2 t -75.6 -26.71 18.36 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.377 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.817 177.268 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 25.9 t -73.73 -39.08 64.53 Favored 'General case' 0 C--N 1.296 -1.725 0 O-C-N 120.96 -1.087 . . . . 0.0 108.583 176.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' TRP . . . . . 0.635 ' CH2' ' HB3' ' A' ' 99' ' ' LYS . 26.1 m0 -79.35 -49.51 12.29 Favored 'General case' 0 N--CA 1.437 -1.097 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.954 -174.369 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 64.5 m-85 -126.84 8.62 6.85 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 114.108 1.151 . . . . 0.0 114.108 -176.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.519 ' HA ' ' O ' ' A' ' 101' ' ' VAL 0.268 6.0 t 49.63 -174.58 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 126.608 1.963 . . . . 0.0 115.584 179.538 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -98.34 157.43 16.19 Favored 'General case' 0 C--N 1.247 -3.862 0 CA-C-N 112.733 -2.031 . . . . 0.0 107.45 -174.421 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 23.2 tpp -74.57 137.96 42.73 Favored 'General case' 1 N--CA 1.369 -4.475 0 CA-C-O 121.749 0.785 . . . . 0.0 109.311 175.372 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -63.35 123.49 18.83 Favored 'General case' 1 N--CA 1.362 -4.844 0 C-N-CA 126.188 1.795 . . . . 0.0 110.583 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 107.97 -15.25 37.12 Favored Glycine 0 N--CA 1.421 -2.31 0 CA-C-N 113.809 -1.541 . . . . 0.0 111.039 -177.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -104.02 156.74 17.61 Favored 'General case' 0 N--CA 1.434 -1.23 0 CA-C-O 121.885 0.85 . . . . 0.0 112.426 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -134.72 141.31 38.18 Favored Pre-proline 0 C--N 1.292 -1.919 0 N-CA-C 106.119 -1.808 . . . . 0.0 106.119 -177.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -48.73 125.34 12.57 Favored 'Trans proline' 0 CA--C 1.47 -2.684 0 C-N-CA 123.962 3.108 . . . . 0.0 115.263 -172.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.426 HG12 HD22 ' A' ' 71' ' ' LEU . 3.7 mp -90.73 109.22 20.64 Favored 'Isoleucine or valine' 1 N--CA 1.377 -4.092 0 CA-C-N 112.411 -2.177 . . . . 0.0 106.011 177.43 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -108.69 138.74 44.53 Favored 'General case' 0 C--N 1.281 -2.387 0 CA-C-O 121.927 0.87 . . . . 0.0 112.397 -177.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.531 ' CG ' HD12 ' A' ' 32' ' ' LEU . 11.8 mmm180 -120.57 -172.12 2.31 Favored 'General case' 0 C--N 1.282 -2.346 0 N-CA-C 104.126 -2.546 . . . . 0.0 104.126 173.031 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 29' ' ' THR . 24.4 pttm -135.48 -167.31 1.99 Allowed 'General case' 0 C--N 1.247 -3.871 0 N-CA-C 107.353 -1.351 . . . . 0.0 107.353 176.167 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.564 HG23 ' O ' ' A' ' 25' ' ' ARG . 59.4 t . . . . . 0 C--N 1.283 -2.291 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 171.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.47 ' HB2' ' CG2' ' A' ' 11' ' ' THR . . . . . . . . 0 N--CA 1.436 -1.148 0 CA-C-O 121.24 0.543 . . . . 0.0 111.307 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.518 ' O ' ' HB ' ' A' ' 11' ' ' THR . 21.2 t70 -74.7 149.25 39.95 Favored 'General case' 0 C--O 1.199 -1.57 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.378 178.246 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.404 ' HA ' ' HG3' ' A' ' 12' ' ' GLN . 18.7 mt -51.43 -38.53 54.08 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.635 0.774 . . . . 0.0 111.2 -177.47 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -67.51 -38.65 84.59 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-N 113.684 -1.598 . . . . 0.0 109.227 -176.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.518 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 8.2 m -74.05 -48.3 30.83 Favored 'General case' 0 N--CA 1.38 -3.929 0 CA-C-N 113.604 -1.634 . . . . 0.0 110.597 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.477 ' HA ' ' CH2' ' A' ' 103' ' ' TRP . 14.5 mt-30 -52.51 -54.29 34.52 Favored 'General case' 0 CA--C 1.48 -1.721 0 O-C-N 123.903 0.752 . . . . 0.0 110.561 -174.688 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.65 ' HD2' ' CH2' ' A' ' 41' ' ' TRP . 4.0 mmm180 -70.6 -32.32 69.62 Favored 'General case' 0 CA--C 1.452 -2.797 0 N-CA-C 115.627 1.714 . . . . 0.0 115.627 -176.081 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 33.8 t -72.02 -45.54 60.5 Favored 'General case' 0 C--N 1.273 -2.72 0 O-C-N 123.971 0.794 . . . . 0.0 110.063 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -70.45 -31.41 68.57 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.927 -175.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.521 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 3.7 mm -80.88 -42.97 20.71 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.714 0 CA-C-N 115.297 -0.865 . . . . 0.0 112.222 176.606 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.546 ' O ' ' HG2' ' A' ' 21' ' ' LYS . . . -55.47 -37.29 67.6 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.473 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.444 ' HA ' ' HD3' ' A' ' 21' ' ' LYS . 1.2 m -63.1 -34.55 77.83 Favored 'General case' 0 N--CA 1.405 -2.718 0 CA-C-N 113.75 -1.568 . . . . 0.0 112.276 -179.284 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 82.9 mt -86.09 -14.03 45.48 Favored 'General case' 0 C--N 1.275 -2.643 0 O-C-N 121.694 -0.629 . . . . 0.0 112.305 -176.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 20.4 mt -84.11 -28.24 27.63 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 178.233 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.546 ' HG2' ' O ' ' A' ' 17' ' ' ALA . 19.2 ptmt -88.47 -23.35 23.27 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 114.705 -1.134 . . . . 0.0 110.945 -175.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.2 m -57.4 141.55 46.89 Favored 'General case' 0 N--CA 1.404 -2.761 0 C-N-CA 125.24 1.416 . . . . 0.0 111.233 173.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.3 m -87.33 170.11 11.69 Favored 'General case' 0 N--CA 1.403 -2.777 0 CA-C-N 114.027 -1.442 . . . . 0.0 111.969 -176.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.504 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP . 0.7 OUTLIER -112.78 163.91 14.02 Favored 'General case' 0 N--CA 1.408 -2.569 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 178.003 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 28.3 mmt180 -104.59 -159.55 0.72 Allowed 'General case' 0 C--N 1.297 -1.675 0 CA-C-N 114.514 -1.221 . . . . 0.0 108.186 176.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -109.64 18.72 19.98 Favored 'General case' 0 N--CA 1.42 -1.963 0 N-CA-C 106.808 -1.552 . . . . 0.0 106.808 175.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.472 ' N ' HG22 ' A' ' 117' ' ' VAL . . . -155.85 29.65 0.6 Allowed Glycine 0 N--CA 1.427 -1.959 0 CA-C-N 114.284 -1.326 . . . . 0.0 112.915 179.182 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.442 ' HB2' ' CG1' ' A' ' 117' ' ' VAL . 57.2 m-20 -95.69 153.36 17.77 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 119.189 -1.004 . . . . 0.0 109.6 176.223 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 98.9 m -104.99 129.21 53.48 Favored 'General case' 0 C--N 1.287 -2.122 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 174.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.504 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 40.9 m95 -116.51 139.11 50.83 Favored 'General case' 0 C--N 1.297 -1.696 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -178.772 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.455 ' CE1' ' HA ' ' A' ' 94' ' ' THR . 72.3 m-85 -104.92 141.78 35.94 Favored 'General case' 0 C--N 1.276 -2.63 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.305 -176.013 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.498 ' HA ' ' O ' ' A' ' 90' ' ' ILE . 6.0 mp -89.65 136.87 32.78 Favored 'General case' 0 CA--C 1.49 -1.344 0 O-C-N 124.383 1.052 . . . . 0.0 111.513 179.67 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.437 HG13 ' O ' ' A' ' 34' ' ' ASP . 81.7 t -121.74 140.36 45.98 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.868 0 N-CA-C 104.41 -2.441 . . . . 0.0 104.41 172.339 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.489 ' OD2' ' HB2' ' A' ' 36' ' ' ARG . 5.5 p-10 -69.69 127.38 32.76 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 106.153 -1.795 . . . . 0.0 106.153 172.157 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 69.6 p -67.37 -19.19 65.39 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-O 121.565 0.698 . . . . 0.0 110.899 -172.407 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.489 ' HB2' ' OD2' ' A' ' 34' ' ' ASP . 44.5 mtt180 -63.9 -48.06 78.14 Favored 'General case' 0 C--N 1.285 -2.235 0 C-N-CA 125.51 1.524 . . . . 0.0 108.29 -177.023 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.458 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 73.6 t90 -63.84 -48.09 78.18 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 124.597 1.159 . . . . 0.0 108.803 177.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 23.3 t80 -61.86 -40.04 93.95 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 114.858 -1.064 . . . . 0.0 111.614 -177.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.412 ' HA ' ' HD3' ' A' ' 42' ' ' LYS . 94.8 mttt -67.02 -34.36 77.56 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 175.649 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.458 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 23.8 tp60 -65.55 -42.39 91.94 Favored 'General case' 0 N--CA 1.423 -1.796 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 175.068 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.65 ' CH2' ' HD2' ' A' ' 13' ' ' ARG . 47.8 t90 -66.04 -37.81 86.79 Favored 'General case' 0 N--CA 1.436 -1.14 0 CA-C-N 114.256 -1.338 . . . . 0.0 110.036 179.805 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.412 ' HD3' ' HA ' ' A' ' 39' ' ' LYS . 12.0 mtpp -53.72 -45.52 70.5 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.746 0.818 . . . . 0.0 113.177 175.195 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.459 ' HG2' ' OD2' ' A' ' 51' ' ' ASP . 51.5 mttm -65.31 -46.25 81.07 Favored 'General case' 0 CA--C 1.507 -0.676 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 177.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -55.29 -33.09 62.93 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 114.306 -1.315 . . . . 0.0 113.539 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.637 HG21 ' O ' ' A' ' 41' ' ' TRP . 5.7 m -102.45 -11.75 8.92 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -179.392 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . 0.447 ' HA3' ' HB2' ' A' ' 52' ' ' LYS . . . 71.71 43.41 51.56 Favored Glycine 0 N--CA 1.415 -2.707 0 C-N-CA 120.003 -1.094 . . . . 0.0 111.554 -175.445 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -66.77 -45.1 79.57 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 176.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -83.44 153.87 24.25 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 115.225 -0.898 . . . . 0.0 108.958 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 5.4 p -84.51 -48.8 9.22 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-O 121.227 0.536 . . . . 0.0 111.921 -179.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 46.6 p90 -73.67 -16.6 61.21 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.752 -177.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.459 ' OD2' ' HG2' ' A' ' 43' ' ' LYS . 30.7 t70 -135.37 87.34 2.32 Favored 'General case' 0 CA--C 1.474 -1.954 0 CA-C-O 121.956 0.884 . . . . 0.0 111.159 -174.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.447 ' HB2' ' HA3' ' A' ' 46' ' ' GLY . 64.7 pttt -157.5 15.47 0.25 Allowed 'General case' 0 N--CA 1.429 -1.483 0 CA-C-N 113.835 -1.53 . . . . 0.0 112.236 -176.305 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 87.5 m-85 -64.1 -10.0 19.82 Favored 'General case' 0 C--N 1.292 -1.927 0 CA-C-N 114.922 -1.036 . . . . 0.0 110.356 173.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.463 ' HB3' HG13 ' A' ' 60' ' ' VAL . 11.0 mm100 -100.72 3.23 42.12 Favored 'General case' 0 N--CA 1.405 -2.724 0 C-N-CA 125.396 1.478 . . . . 0.0 110.753 -176.647 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 48.7 ttp -65.09 109.13 2.05 Favored 'General case' 0 N--CA 1.426 -1.631 0 CA-C-O 121.227 0.537 . . . . 0.0 111.818 -176.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 89.95 2.36 75.04 Favored Glycine 0 N--CA 1.429 -1.777 0 CA-C-N 114.357 -1.292 . . . . 0.0 111.756 -178.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.466 ' HB3' HG23 ' A' ' 60' ' ' VAL . 4.8 t70 -77.28 152.27 34.68 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 -177.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.454 ' O ' ' HD2' ' A' ' 61' ' ' TYR . 20.7 pt20 -84.15 -24.32 30.27 Favored 'General case' 0 C--N 1.292 -1.895 0 CA-C-O 121.609 0.719 . . . . 0.0 109.809 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -61.13 -21.1 63.42 Favored 'General case' 0 CA--C 1.498 -1.039 0 CA-C-N 115.351 -0.84 . . . . 0.0 112.015 -179.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.466 HG23 ' HB3' ' A' ' 57' ' ' ASP . 28.8 m -119.47 2.39 7.18 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.073 0 CA-C-N 115.19 -0.914 . . . . 0.0 112.359 -173.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.454 ' HD2' ' O ' ' A' ' 58' ' ' GLN . 0.9 OUTLIER -65.3 114.63 16.19 Favored Pre-proline 0 C--N 1.314 -0.978 0 O-C-N 124.121 0.888 . . . . 0.0 110.504 -177.552 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -89.86 113.33 0.53 Allowed 'Trans proline' 0 N--CA 1.419 -2.871 0 C-N-CA 122.491 2.128 . . . . 0.0 109.688 177.052 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -70.64 -140.05 0.18 Allowed Glycine 0 C--N 1.281 -2.514 0 CA-C-N 114.923 -1.035 . . . . 0.0 113.163 177.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.431 ' HA ' ' O ' ' A' ' 104' ' ' TYR . 11.8 Cg_endo -56.16 145.24 77.28 Favored 'Trans proline' 0 C--O 1.252 1.205 0 C-N-CA 122.67 2.247 . . . . 0.0 112.739 -178.2 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 60.9 mt -72.63 117.09 15.67 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.98 -178.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.535 ' HB2' ' HG3' ' A' ' 107' ' ' MET . 17.0 t0 -116.33 104.53 11.57 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-O 121.896 0.855 . . . . 0.0 111.384 178.389 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.645 ' O ' HD22 ' A' ' 71' ' ' LEU . 42.9 m-80 -92.91 5.86 49.86 Favored 'General case' 0 C--N 1.284 -2.245 0 CA-C-N 114.899 -1.046 . . . . 0.0 111.04 -178.621 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 19.2 t -72.74 83.89 1.18 Allowed 'General case' 0 N--CA 1.445 -0.676 0 CA-C-O 122.523 1.154 . . . . 0.0 107.899 177.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 169.25 -20.74 0.08 OUTLIER Glycine 0 N--CA 1.42 -2.414 0 N-CA-C 108.45 -1.86 . . . . 0.0 108.45 -175.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 79.2 mt -88.41 -29.53 20.16 Favored 'General case' 0 CA--C 1.484 -1.568 0 N-CA-C 104.667 -2.345 . . . . 0.0 104.667 171.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.645 HD22 ' O ' ' A' ' 67' ' ' ASN . 2.2 mm? -75.88 156.79 33.99 Favored 'General case' 0 N--CA 1.38 -3.959 0 CA-C-N 110.781 -2.918 . . . . 0.0 107.084 173.114 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.449 ' HG3' ' O ' ' A' ' 78' ' ' SER . 38.0 mtpt . . . . . 0 C--N 1.292 -1.892 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 -174.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.932 0 CA-C-O 121.147 0.499 . . . . 0.0 109.71 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . 0.555 HE21 ' HA ' ' A' ' 77' ' ' GLN . 0.0 OUTLIER -116.9 -14.17 10.67 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-O 121.732 0.777 . . . . 0.0 110.175 179.927 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.449 ' O ' ' HG3' ' A' ' 72' ' ' LYS . 20.2 m -108.15 119.71 40.27 Favored 'General case' 0 C--N 1.299 -1.629 0 CA-C-N 114.81 -1.086 . . . . 0.0 110.845 -175.276 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.412 ' HA ' ' HA ' ' A' ' 71' ' ' LEU . 3.0 mm? -81.58 148.8 28.93 Favored 'General case' 0 N--CA 1.437 -1.087 0 C-N-CA 123.914 0.886 . . . . 0.0 111.986 -179.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -63.68 151.9 40.59 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.557 176.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -75.1 -35.83 61.72 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-O 122.145 0.974 . . . . 0.0 108.653 -178.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 15.4 t-80 -88.07 12.8 12.58 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-N 114.486 -1.234 . . . . 0.0 112.795 -170.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.406 ' HB3' ' CE2' ' A' ' 89' ' ' TYR . 43.2 mt -57.23 141.63 45.88 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 114.263 1.208 . . . . 0.0 114.263 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.476 HG22 HD11 ' A' ' 84' ' ' ILE . 62.8 mt -137.14 166.49 25.37 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 N-CA-C 106.251 -1.759 . . . . 0.0 106.251 -178.519 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.618 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 17.7 t70 -62.55 -146.22 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.213 0 C-N-CA 125.582 1.553 . . . . 0.0 110.586 -178.097 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.71 ' HA ' ' O ' ' A' ' 89' ' ' TYR 0.271 0.0 OUTLIER -40.74 -18.19 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.662 0 N-CA-C 117.014 2.228 . . . . 0.0 117.014 -174.029 . . . . . . . . 4 4 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.47 HD11 HG22 ' A' ' 84' ' ' ILE . 44.4 mt -61.02 -61.03 2.87 Favored 'General case' 0 C--N 1.281 -2.411 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.838 170.113 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -97.83 -41.19 8.16 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 -176.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' TYR . . . . . 0.71 ' O ' ' HA ' ' A' ' 86' ' ' GLU . 1.3 p90 -139.9 -169.15 2.66 Favored 'General case' 0 C--O 1.155 -3.892 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.571 -174.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.498 ' O ' ' HA ' ' A' ' 32' ' ' LEU . 10.3 mt -146.21 153.01 13.41 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.343 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 170.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.443 ' N ' HG21 ' A' ' 90' ' ' ILE . 81.7 mt -117.73 134.69 54.65 Favored 'General case' 0 N--CA 1.413 -2.302 0 O-C-N 124.2 0.938 . . . . 0.0 110.907 177.14 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.406 ' N ' HD13 ' A' ' 92' ' ' LEU . 1.8 mp -140.2 159.53 63.53 Favored Pre-proline 0 C--N 1.291 -1.971 0 N-CA-C 106.794 -1.558 . . . . 0.0 106.794 -177.516 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -63.46 168.75 10.8 Favored 'Trans proline' 0 C--O 1.256 1.389 0 C-N-CA 121.992 1.795 . . . . 0.0 110.251 175.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.455 ' HA ' ' CE1' ' A' ' 31' ' ' TYR . 33.0 m -42.8 -47.95 5.59 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 124.532 1.145 . . . . 0.0 110.799 172.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -66.21 -38.15 87.26 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-N 114.613 -1.176 . . . . 0.0 112.33 -175.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.461 ' O ' ' HG ' ' A' ' 100' ' ' LEU . . . -62.18 -51.3 57.64 Favored Glycine 0 N--CA 1.429 -1.815 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 -179.278 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.412 ' CE2' ' HB3' ' A' ' 112' ' ' PRO . 69.1 t-105 -57.54 -50.04 74.38 Favored 'General case' 0 N--CA 1.428 -1.566 0 CA-C-N 114.594 -0.803 . . . . 0.0 110.35 174.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -48.26 -45.22 34.28 Favored 'General case' 0 CA--C 1.489 -1.368 0 O-C-N 123.788 0.68 . . . . 0.0 111.621 176.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 60.5 mttm -66.4 -45.27 80.55 Favored 'General case' 0 N--CA 1.426 -1.639 0 CA-C-O 120.639 0.257 . . . . 0.0 110.625 -177.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' A' ' 96' ' ' GLY . 64.9 mt -65.1 -34.23 77.92 Favored 'General case' 0 C--N 1.292 -1.934 0 CA-C-O 121.403 0.62 . . . . 0.0 111.289 -178.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.441 ' HA ' ' HA ' ' A' ' 105' ' ' THR . 8.8 t -78.84 -23.8 13.0 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.456 0 CA-C-O 121.771 0.796 . . . . 0.0 111.12 176.594 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 67.1 m -73.51 -37.98 65.5 Favored 'General case' 0 N--CA 1.418 -2.031 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 174.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' TRP . . . . . 0.477 ' CH2' ' HA ' ' A' ' 12' ' ' GLN . 44.8 m0 -84.34 -42.44 15.75 Favored 'General case' 0 N--CA 1.424 -1.758 0 CA-C-N 114.995 -1.002 . . . . 0.0 112.959 -174.28 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' TYR . . . . . 0.431 ' O ' ' HA ' ' A' ' 64' ' ' PRO . 73.1 m-85 -127.63 -5.28 5.84 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 111.817 0.303 . . . . 0.0 111.817 -174.418 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.441 ' HA ' ' HA ' ' A' ' 101' ' ' VAL 0.288 13.7 t 50.62 -174.11 0.02 OUTLIER 'General case' 0 C--O 1.247 0.927 0 C-N-CA 125.788 1.635 . . . . 0.0 113.979 -173.69 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.454 ' HG ' ' N ' ' A' ' 107' ' ' MET . 37.1 tp -107.13 149.85 27.21 Favored 'General case' 0 C--N 1.244 -3.996 0 CA-C-N 113.305 -1.77 . . . . 0.0 109.057 -177.419 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' MET . . . . . 0.535 ' HG3' ' HB2' ' A' ' 66' ' ' ASP . 80.3 mmm -59.38 154.37 16.99 Favored 'General case' 0 CA--C 1.492 -1.267 0 CA-C-O 122.131 0.967 . . . . 0.0 111.039 173.236 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -76.57 140.31 41.02 Favored 'General case' 0 N--CA 1.396 -3.165 0 CA-C-N 114.468 -1.242 . . . . 0.0 111.322 -176.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 88.84 -25.9 9.15 Favored Glycine 0 N--CA 1.412 -2.904 0 CA-C-N 114.743 -1.117 . . . . 0.0 113.667 175.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -92.01 172.19 8.61 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 119.681 -0.808 . . . . 0.0 109.355 -177.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -121.67 158.33 54.46 Favored Pre-proline 0 N--CA 1.432 -1.352 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -177.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . 0.412 ' HB3' ' CE2' ' A' ' 97' ' ' TRP . 22.9 Cg_exo -67.79 122.39 9.54 Favored 'Trans proline' 0 CA--C 1.448 -3.792 0 C-N-CA 122.358 2.039 . . . . 0.0 109.174 169.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 3.3 mp -82.79 109.33 16.55 Favored 'Isoleucine or valine' 1 N--CA 1.375 -4.208 0 CA-C-N 114.322 -1.308 . . . . 0.0 108.057 -178.637 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -102.13 137.98 39.69 Favored 'General case' 0 C--N 1.277 -2.574 0 CA-C-N 115.472 -0.786 . . . . 0.0 109.975 179.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.426 ' HB2' HD13 ' A' ' 32' ' ' LEU . 5.7 tpt180 -135.34 -178.71 5.23 Favored 'General case' 0 N--CA 1.402 -2.857 0 N-CA-C 103.841 -2.651 . . . . 0.0 103.841 178.269 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . 0.401 ' H ' ' HG3' ' A' ' 115' ' ' ARG . 16.9 ptpt -137.03 179.27 6.48 Favored 'General case' 0 N--CA 1.402 -2.87 0 C-N-CA 118.217 -1.393 . . . . 0.0 113.27 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.472 HG22 ' N ' ' A' ' 27' ' ' GLY . 7.3 m . . . . . 0 N--CA 1.383 -3.793 0 CA-C-N 111.408 -2.633 . . . . 0.0 112.915 174.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.453 ' HB2' ' CG2' ' A' ' 11' ' ' THR . . . . . . . . 0 CA--C 1.502 -0.887 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.669 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 13.8 t70 -69.14 145.46 53.32 Favored 'General case' 0 CA--C 1.467 -2.213 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 177.611 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -40.75 -51.53 3.07 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 126.083 1.753 . . . . 0.0 112.579 178.043 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -76.07 -31.55 58.83 Favored 'General case' 0 C--N 1.276 -2.587 0 CA-C-N 113.638 -1.619 . . . . 0.0 110.771 -176.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.51 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 3.7 m -65.14 -46.29 81.54 Favored 'General case' 0 N--CA 1.4 -2.94 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 177.271 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.669 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 53.7 mt-30 -54.66 -44.14 73.0 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-N 114.848 -1.069 . . . . 0.0 109.413 -179.081 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.477 ' CG ' ' HB ' ' A' ' 45' ' ' VAL . 3.2 mmp_? -70.32 -41.4 73.32 Favored 'General case' 0 N--CA 1.411 -2.387 0 N-CA-C 113.412 0.894 . . . . 0.0 113.412 -178.472 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.2 m -64.36 -46.3 84.02 Favored 'General case' 0 C--N 1.251 -3.683 0 CA-C-O 121.414 0.626 . . . . 0.0 110.484 -178.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.435 ' O ' ' HB ' ' A' ' 18' ' ' THR . 51.3 t0 -67.72 -46.83 71.07 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 114.659 -1.155 . . . . 0.0 109.671 -177.75 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.64 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 21.6 mm -71.94 -39.39 66.82 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.58 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.993 -177.449 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.509 ' O ' ' HG2' ' A' ' 21' ' ' LYS . . . -58.61 -34.8 71.54 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 -179.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.514 ' HA ' ' CE ' ' A' ' 21' ' ' LYS . 2.9 m -66.94 -42.07 85.92 Favored 'General case' 0 N--CA 1.4 -2.943 0 CA-C-N 113.975 -1.466 . . . . 0.0 111.905 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 82.0 mt -78.77 -12.67 60.03 Favored 'General case' 0 C--N 1.268 -2.962 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -175.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.64 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 20.6 mt -82.17 -31.48 30.42 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.098 -0.705 . . . . 0.0 109.098 176.264 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.514 ' CE ' ' HA ' ' A' ' 18' ' ' THR . 48.2 pttt -92.69 -25.93 18.02 Favored 'General case' 0 N--CA 1.425 -1.723 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.439 -174.101 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 31.8 m -67.73 137.67 55.66 Favored 'General case' 0 N--CA 1.398 -3.045 0 CA-C-O 122.336 1.065 . . . . 0.0 112.089 177.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.469 ' HA ' HD11 ' A' ' 24' ' ' LEU . 36.8 t -94.77 167.68 11.29 Favored 'General case' 0 N--CA 1.391 -3.421 0 CA-C-N 112.928 -1.942 . . . . 0.0 109.306 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.587 HD11 ' N ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -105.19 177.95 4.7 Favored 'General case' 1 N--CA 1.377 -4.101 0 CA-C-N 112.834 -1.985 . . . . 0.0 114.301 -167.267 . . . . . . . . 4 4 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.623 ' O ' HG23 ' A' ' 117' ' ' VAL . 25.1 mmt180 -134.13 143.24 47.83 Favored 'General case' 0 C--N 1.285 -2.215 0 CA-C-N 112.643 -2.071 . . . . 0.0 106.834 175.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 44.0 mtpt -67.9 95.19 0.51 Allowed 'General case' 0 C--N 1.306 -1.319 0 CA-C-O 121.808 0.813 . . . . 0.0 109.596 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 143.37 19.52 0.22 Allowed Glycine 0 N--CA 1.426 -1.971 0 CA-C-N 114.17 -1.377 . . . . 0.0 110.554 -174.355 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -103.58 -179.63 4.0 Favored 'General case' 0 CA--C 1.499 -1.008 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 176.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 86.1 m -140.97 127.3 19.79 Favored 'General case' 0 N--CA 1.42 -1.958 0 N-CA-C 106.576 -1.638 . . . . 0.0 106.576 176.015 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.457 ' CZ2' HD13 ' A' ' 24' ' ' LEU . 42.2 m95 -112.84 119.4 37.88 Favored 'General case' 0 C--N 1.301 -1.502 0 CA-C-O 121.021 0.439 . . . . 0.0 109.988 -177.172 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 86.5 m-85 -94.36 148.67 21.99 Favored 'General case' 0 C--N 1.277 -2.545 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.594 -176.154 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.594 ' HA ' ' O ' ' A' ' 90' ' ' ILE . 6.2 mp -98.1 139.72 33.49 Favored 'General case' 0 CA--C 1.475 -1.932 0 O-C-N 124.042 0.839 . . . . 0.0 111.008 178.567 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.442 ' HA ' ' OD1' ' A' ' 67' ' ' ASN . 59.4 t -118.44 138.68 48.37 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.878 0 N-CA-C 105.52 -2.03 . . . . 0.0 105.52 172.343 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.494 ' OD1' ' HG2' ' A' ' 36' ' ' ARG . 19.5 t0 -63.8 128.7 36.98 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 106.86 -1.533 . . . . 0.0 106.86 171.777 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 83.0 p -68.15 -27.12 66.15 Favored 'General case' 0 C--O 1.193 -1.91 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 -170.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.494 ' HG2' ' OD1' ' A' ' 34' ' ' ASP . 19.1 mmt180 -64.59 -39.34 93.55 Favored 'General case' 0 N--CA 1.433 -1.322 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.329 -175.774 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.48 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 66.8 t90 -68.41 -47.27 67.72 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 178.019 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.448 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 39.3 t80 -60.72 -39.71 89.63 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.422 -179.831 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.441 ' HA ' ' HE3' ' A' ' 42' ' ' LYS . 93.1 mttt -66.36 -32.29 73.59 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 122.819 0.448 . . . . 0.0 111.98 176.795 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.48 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 19.7 tp60 -68.94 -42.02 77.29 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 174.104 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.621 ' O ' HG23 ' A' ' 45' ' ' VAL . 52.9 t90 -64.45 -37.27 86.96 Favored 'General case' 0 N--CA 1.428 -1.574 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.685 177.165 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.448 ' HG3' ' O ' ' A' ' 38' ' ' PHE . 7.2 mtmp? -51.37 -47.78 62.71 Favored 'General case' 0 C--N 1.369 1.424 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 175.222 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.438 ' HG2' ' OD1' ' A' ' 51' ' ' ASP . 63.3 mttm -55.03 -50.42 69.1 Favored 'General case' 0 CA--C 1.499 -1.009 0 O-C-N 124.178 0.924 . . . . 0.0 109.938 177.824 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.512 ' O ' ' HA ' ' A' ' 55' ' ' MET . 5.1 t80 -60.09 -38.99 84.55 Favored 'General case' 0 C--N 1.309 -1.152 0 CA-C-N 114.032 -1.44 . . . . 0.0 113.605 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.621 HG23 ' O ' ' A' ' 41' ' ' TRP . 0.2 OUTLIER -91.2 -30.04 4.8 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.519 0 N-CA-C 114.39 1.255 . . . . 0.0 114.39 -179.516 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . 0.574 ' HA3' ' CB ' ' A' ' 52' ' ' LYS . . . 87.92 34.76 9.62 Favored Glycine 0 N--CA 1.4 -3.742 0 C-N-CA 120.229 -0.986 . . . . 0.0 112.69 -176.334 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.47 ' CD1' ' CZ ' ' A' ' 13' ' ' ARG . 89.9 t80 -60.7 -49.81 76.0 Favored 'General case' 0 CA--C 1.508 -0.672 0 CA-C-O 121.814 0.816 . . . . 0.0 110.257 177.502 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.469 ' CB ' ' HB3' ' A' ' 51' ' ' ASP . 1.5 t0 -81.94 -176.65 6.23 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 114.123 -1.399 . . . . 0.0 110.717 -168.257 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' SER . . . . . 0.416 ' O ' ' HE2' ' A' ' 52' ' ' LYS . 16.9 m -91.68 -42.96 9.88 Favored 'General case' 0 C--N 1.292 -1.927 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.625 -177.333 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.484 ' CE2' ' HB2' ' A' ' 51' ' ' ASP . 64.8 p-90 -101.29 -20.17 15.34 Favored 'General case' 0 N--CA 1.395 -3.187 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 -176.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.484 ' HB2' ' CE2' ' A' ' 50' ' ' TRP . 31.0 t70 -103.37 78.62 1.63 Allowed 'General case' 0 CA--C 1.459 -2.548 0 CA-C-N 114.07 -1.423 . . . . 0.0 109.057 -169.343 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.574 ' CB ' ' HA3' ' A' ' 46' ' ' GLY . 65.5 pttt -169.92 3.55 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.429 0 CA-C-N 113.632 -1.622 . . . . 0.0 114.829 -174.322 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -64.6 -9.59 20.46 Favored 'General case' 0 C--N 1.299 -1.598 0 CA-C-O 121.561 0.696 . . . . 0.0 110.898 175.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.413 ' HB2' ' HB3' ' A' ' 43' ' ' LYS . 13.1 mm100 -106.62 19.32 20.66 Favored 'General case' 0 N--CA 1.416 -2.147 0 C-N-CA 124.344 1.058 . . . . 0.0 109.832 -176.319 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' MET . . . . . 0.512 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 48.8 ttm -58.69 109.17 0.75 Allowed 'General case' 0 N--CA 1.424 -1.768 0 CA-C-O 121.444 0.64 . . . . 0.0 111.335 -178.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.91 23.9 75.31 Favored Glycine 0 N--CA 1.439 -1.131 0 CA-C-N 115.177 -0.92 . . . . 0.0 112.195 -178.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -95.04 151.88 18.8 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-O 121.115 0.483 . . . . 0.0 110.786 -175.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -83.69 -21.33 32.4 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.103 -178.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -63.51 -18.86 64.25 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.03 -0.986 . . . . 0.0 111.918 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 12.7 m -115.24 -9.12 12.3 Favored 'Isoleucine or valine' 0 CA--C 1.443 -3.172 0 CA-C-O 118.327 -0.844 . . . . 0.0 112.834 -178.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 1.6 p90 -34.34 100.47 0.19 Allowed Pre-proline 0 CA--C 1.557 1.219 0 O-C-N 126.3 2.25 . . . . 0.0 114.181 -163.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -78.29 102.46 1.57 Allowed 'Trans proline' 0 N--CA 1.425 -2.543 0 C-N-CA 122.797 2.331 . . . . 0.0 109.777 174.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -82.01 -146.87 5.91 Favored Glycine 0 C--N 1.295 -1.715 0 CA-C-N 114.29 -1.323 . . . . 0.0 111.629 177.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.467 ' HA ' ' O ' ' A' ' 104' ' ' TYR . 86.8 Cg_exo -50.23 133.92 36.68 Favored 'Trans proline' 0 C--O 1.238 0.492 0 C-N-CA 123.763 2.975 . . . . 0.0 113.82 178.747 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.416 HD13 ' HB3' ' A' ' 100' ' ' LEU . 45.2 mt -68.53 115.12 6.25 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 CA-C-N 114.764 -1.107 . . . . 0.0 111.437 -176.07 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -110.82 121.24 44.85 Favored 'General case' 0 C--N 1.289 -2.033 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 173.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.442 ' OD1' ' HA ' ' A' ' 33' ' ' VAL . 38.5 m-80 -109.03 18.47 20.6 Favored 'General case' 0 C--N 1.306 -1.3 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.725 -176.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 10.0 t -68.8 -2.7 10.08 Favored 'General case' 0 CA--C 1.552 1.039 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -176.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -83.74 -19.88 60.81 Favored Glycine 0 N--CA 1.441 -1.011 0 N-CA-C 111.607 -0.597 . . . . 0.0 111.607 176.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 64.7 mt -91.09 -25.89 19.4 Favored 'General case' 0 CA--C 1.499 -1.018 0 CA-C-O 121.79 0.805 . . . . 0.0 109.699 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 50.1 mt -71.36 129.48 38.93 Favored 'General case' 0 N--CA 1.421 -1.876 0 CA-C-N 114.087 -1.415 . . . . 0.0 110.892 -173.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 73.2 tttt . . . . . 0 N--CA 1.402 -2.867 0 CA-C-N 114.483 -1.235 . . . . 0.0 109.824 -178.766 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.463 0 CA-C-O 121.88 0.848 . . . . 0.0 110.567 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 20.8 mm-40 -112.41 -3.21 14.53 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-O 122.414 1.102 . . . . 0.0 108.221 178.162 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 68.0 m -100.74 137.45 39.12 Favored 'General case' 0 C--N 1.284 -2.252 0 CA-C-N 113.481 -1.69 . . . . 0.0 109.586 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.417 HD22 HG23 ' A' ' 113' ' ' ILE . 96.6 mt -106.94 153.02 23.16 Favored 'General case' 0 C--N 1.296 -1.718 0 CA-C-O 120.953 0.406 . . . . 0.0 111.402 -178.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -65.14 153.09 41.89 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.28 175.069 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -77.0 -33.84 57.55 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 114.581 1.326 . . . . 0.0 114.581 -169.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 19.5 t-80 -98.35 11.76 37.02 Favored 'General case' 0 C--N 1.298 -1.658 0 CA-C-O 120.696 0.284 . . . . 0.0 111.726 -172.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 83.2 mt -66.36 118.63 10.29 Favored 'General case' 0 C--N 1.307 -1.259 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -176.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.406 HG22 HD11 ' A' ' 87' ' ' LEU . 44.8 mm -92.56 170.43 1.23 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 N-CA-C 106.674 -1.602 . . . . 0.0 106.674 175.398 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.677 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 22.4 t70 -60.62 -130.53 0.0 OUTLIER 'General case' 0 CA--C 1.577 2.011 0 C-N-CA 125.472 1.509 . . . . 0.0 112.403 -177.589 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.685 ' HA ' ' O ' ' A' ' 89' ' ' TYR . 9.6 pt-20 -47.51 -17.39 0.09 Allowed 'General case' 0 N--CA 1.5 2.075 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 -176.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.406 HD11 HG22 ' A' ' 84' ' ' ILE . 11.8 mt -67.65 -54.22 21.43 Favored 'General case' 0 C--N 1.29 -2.005 0 CA-C-N 115.201 -0.909 . . . . 0.0 110.394 176.201 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -101.48 -33.8 9.81 Favored 'General case' 0 CA--C 1.499 -0.989 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.136 -178.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' TYR . . . . . 0.685 ' O ' ' HA ' ' A' ' 86' ' ' GLU . 4.8 p90 -141.11 -160.61 1.1 Allowed 'General case' 0 C--O 1.183 -2.398 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 -179.188 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.594 ' O ' ' HA ' ' A' ' 32' ' ' LEU . 1.2 mm -141.19 145.43 24.98 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.879 0 N-CA-C 106.908 -1.515 . . . . 0.0 106.908 172.24 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 58.2 mt -116.93 123.9 48.09 Favored 'General case' 0 N--CA 1.42 -1.967 0 CA-C-O 121.784 0.802 . . . . 0.0 111.122 171.035 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.415 HD12 ' HB ' ' A' ' 90' ' ' ILE . 1.0 OUTLIER -137.07 155.38 76.15 Favored Pre-proline 0 C--N 1.289 -2.049 0 CA-C-N 114.171 -1.377 . . . . 0.0 108.526 -175.493 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -61.56 169.24 7.06 Favored 'Trans proline' 0 C--O 1.255 1.338 0 C-N-CA 123.213 2.609 . . . . 0.0 110.786 176.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.452 HG23 ' ND2' ' A' ' 98' ' ' ASN . 32.3 m -47.17 -43.28 21.04 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 123.96 0.788 . . . . 0.0 109.406 173.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.505 ' HB3' ' HE2' ' A' ' 99' ' ' LYS . 9.2 mm-40 -56.28 -51.26 68.81 Favored 'General case' 0 C--O 1.196 -1.73 0 C-N-CA 124.422 1.089 . . . . 0.0 111.079 178.266 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.513 ' O ' HD23 ' A' ' 100' ' ' LEU . . . -50.87 -62.11 5.56 Favored Glycine 0 CA--C 1.497 -1.085 0 O-C-N 124.322 1.014 . . . . 0.0 111.567 -177.6 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 68.5 t-105 -53.5 -50.79 64.65 Favored 'General case' 0 C--N 1.309 -1.152 0 C-N-CA 123.696 0.799 . . . . 0.0 110.905 177.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.452 ' ND2' HG23 ' A' ' 94' ' ' THR . 91.3 m-20 -52.2 -34.57 46.08 Favored 'General case' 0 C--O 1.207 -1.148 0 O-C-N 123.562 0.539 . . . . 0.0 112.118 177.058 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.505 ' HE2' ' HB3' ' A' ' 95' ' ' GLU . 50.8 mttm -75.01 -51.67 13.01 Favored 'General case' 0 N--CA 1.412 -2.358 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.513 HD23 ' O ' ' A' ' 96' ' ' GLY . 0.7 OUTLIER -58.95 -39.79 82.71 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.379 0.609 . . . . 0.0 111.534 -179.041 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.441 ' O ' ' HA ' ' A' ' 105' ' ' THR . 20.5 t -73.51 -31.08 31.63 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.172 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.851 177.559 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 37.5 t -73.91 -35.09 64.6 Favored 'General case' 0 C--N 1.314 -0.972 0 O-C-N 121.535 -0.728 . . . . 0.0 109.036 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' TRP . . . . . 0.463 ' CZ3' ' HB3' ' A' ' 12' ' ' GLN . 49.4 m0 -78.24 -50.2 12.33 Favored 'General case' 0 N--CA 1.421 -1.924 0 CA-C-N 114.773 -1.103 . . . . 0.0 112.031 -176.731 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' TYR . . . . . 0.467 ' O ' ' HA ' ' A' ' 64' ' ' PRO . 55.2 m-85 -128.9 10.16 5.92 Favored 'General case' 0 CA--C 1.505 -0.764 0 N-CA-C 114.498 1.296 . . . . 0.0 114.498 -172.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.441 ' HA ' ' O ' ' A' ' 101' ' ' VAL 0.274 7.2 p 56.33 174.63 0.04 OUTLIER 'General case' 0 N--CA 1.418 -2.038 0 N-CA-C 117.025 2.231 . . . . 0.0 117.025 179.164 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.522 ' HG ' ' N ' ' A' ' 107' ' ' MET . 28.6 tp -104.93 161.59 14.07 Favored 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 114.57 -1.196 . . . . 0.0 108.487 -179.12 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' MET . . . . . 0.522 ' N ' ' HG ' ' A' ' 106' ' ' LEU . 24.4 tpp -72.19 141.06 49.04 Favored 'General case' 0 N--CA 1.38 -3.967 0 CA-C-O 122.047 0.927 . . . . 0.0 109.241 173.26 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . 0.276 6.7 tp10 -74.99 125.87 29.81 Favored 'General case' 1 N--CA 1.346 -5.625 0 CA-C-N 113.504 -1.68 . . . . 0.0 110.181 -174.547 . . . . . . . . 3 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 104.22 -6.25 46.31 Favored Glycine 0 N--CA 1.412 -2.959 0 CA-C-N 114.589 -1.187 . . . . 0.0 112.661 177.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -109.34 158.08 18.25 Favored 'General case' 0 CA--C 1.494 -1.207 0 C-N-CA 117.936 -1.505 . . . . 0.0 109.805 177.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -122.39 133.47 24.4 Favored Pre-proline 0 C--N 1.286 -2.187 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -177.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -41.66 133.59 3.73 Favored 'Trans proline' 0 CA--C 1.477 -2.372 0 C-N-CA 124.687 3.591 . . . . 0.0 114.671 -177.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.417 HG23 HD22 ' A' ' 79' ' ' LEU . 3.6 mp -96.34 108.74 21.71 Favored 'Isoleucine or valine' 0 N--CA 1.385 -3.709 0 CA-C-N 113.053 -1.885 . . . . 0.0 107.007 179.437 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -113.72 147.89 37.4 Favored 'General case' 0 C--N 1.283 -2.283 0 CA-C-O 122.072 0.939 . . . . 0.0 113.024 -176.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.471 ' CG ' HD12 ' A' ' 32' ' ' LEU . 3.0 mmp_? -127.02 177.62 6.52 Favored 'General case' 0 CA--C 1.476 -1.867 0 N-CA-C 105.537 -2.023 . . . . 0.0 105.537 174.002 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -134.22 166.75 22.07 Favored 'General case' 0 C--N 1.258 -3.39 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' ' 25' ' ' ARG . 59.8 t . . . . . 0 C--N 1.308 -1.222 0 CA-C-O 122.493 1.139 . . . . 0.0 111.386 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.426 ' HB2' ' CG2' ' A' ' 11' ' ' THR . . . . . . . . 0 CA--C 1.495 -1.162 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.6 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 12.5 t70 -68.24 144.3 54.95 Favored 'General case' 0 C--N 1.291 -1.961 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 173.373 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.464 ' O ' ' HG3' ' A' ' 13' ' ' ARG . 3.1 mm? -43.63 -53.12 5.94 Favored 'General case' 0 C--N 1.298 -1.662 0 C-N-CA 125.906 1.682 . . . . 0.0 112.67 177.802 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -67.9 -34.49 76.73 Favored 'General case' 0 C--N 1.276 -2.604 0 CA-C-N 114.61 -1.177 . . . . 0.0 110.293 -177.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.469 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 2.9 m -66.44 -46.66 75.73 Favored 'General case' 0 N--CA 1.384 -3.747 0 CA-C-N 114.99 -1.005 . . . . 0.0 110.522 178.042 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.6 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 71.0 mt-30 -56.1 -53.82 52.46 Favored 'General case' 0 N--CA 1.444 -0.758 0 O-C-N 123.548 0.53 . . . . 0.0 110.577 -177.581 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.464 ' HG3' ' O ' ' A' ' 9' ' ' LEU . 59.2 mtt180 -46.64 -58.57 3.7 Favored 'General case' 0 N--CA 1.487 1.381 0 CA-C-O 122.432 1.11 . . . . 0.0 109.798 177.208 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 54.7 m -66.89 -45.49 77.86 Favored 'General case' 0 C--N 1.295 -1.787 0 CA-C-N 113.068 -1.878 . . . . 0.0 113.306 -170.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -67.82 -32.38 72.89 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.51 -175.188 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.495 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 27.7 mm -82.5 -38.29 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.142 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.274 177.106 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.07 -34.95 72.55 Favored 'General case' 0 CA--C 1.501 -0.941 0 CA-C-O 122.027 0.917 . . . . 0.0 108.73 179.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 2.6 m -64.81 -33.88 77.04 Favored 'General case' 0 N--CA 1.401 -2.912 0 CA-C-N 113.656 -1.611 . . . . 0.0 111.299 177.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.599 ' HB3' ' CG ' ' A' ' 93' ' ' PRO . 89.7 mt -85.94 -12.97 49.12 Favored 'General case' 0 C--N 1.267 -3.003 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -176.454 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 11.6 mt -86.43 -21.63 26.99 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 176.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.75 -4.44 37.06 Favored 'General case' 0 N--CA 1.426 -1.649 0 CA-C-N 114.537 -1.21 . . . . 0.0 111.333 -174.649 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.484 ' OG1' ' HA ' ' A' ' 19' ' ' LEU . 52.8 m -54.59 134.5 46.72 Favored 'General case' 0 N--CA 1.398 -3.075 0 C-N-CA 126.291 1.836 . . . . 0.0 111.351 173.323 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 68.3 m -70.48 132.64 45.87 Favored 'General case' 0 N--CA 1.387 -3.592 0 CA-C-N 113.405 -1.725 . . . . 0.0 111.338 179.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.404 HD21 HG11 ' A' ' 117' ' ' VAL . 1.7 pp -110.68 159.43 17.6 Favored 'General case' 0 N--CA 1.411 -2.408 0 CA-C-N 115.353 -0.84 . . . . 0.0 112.592 179.021 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.68 ' O ' HG12 ' A' ' 117' ' ' VAL . 19.9 mmt180 -105.51 -144.68 0.38 Allowed 'General case' 0 C--N 1.271 -2.821 0 N-CA-C 103.727 -2.694 . . . . 0.0 103.727 177.684 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -128.91 14.93 6.36 Favored 'General case' 0 C--N 1.283 -2.323 0 CA-C-O 122.108 0.956 . . . . 0.0 109.868 166.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -130.89 20.53 4.8 Favored Glycine 0 N--CA 1.429 -1.803 0 CA-C-N 114.149 -1.387 . . . . 0.0 112.474 -179.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 45.0 m-20 -91.03 169.61 10.73 Favored 'General case' 0 CA--C 1.492 -1.258 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 177.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.509 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 85.1 m -118.67 130.68 55.98 Favored 'General case' 0 N--CA 1.409 -2.512 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 175.72 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 33.4 m95 -114.7 155.98 25.63 Favored 'General case' 0 C--N 1.284 -2.277 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 177.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.454 ' HB2' ' HB2' ' A' ' 97' ' ' TRP . 84.9 m-85 -111.25 129.83 55.85 Favored 'General case' 0 C--N 1.264 -3.152 0 CA-C-O 121.04 0.448 . . . . 0.0 110.055 -178.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.823 HD12 ' CG ' ' A' ' 89' ' ' TYR . 26.3 tp -86.84 138.96 31.14 Favored 'General case' 1 N--CA 1.376 -4.17 0 N-CA-C 114.374 1.249 . . . . 0.0 114.374 -174.841 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.502 HG13 ' O ' ' A' ' 34' ' ' ASP . 46.3 t -132.85 154.04 39.02 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.465 0 C-N-CA 126.498 1.919 . . . . 0.0 107.821 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.502 ' O ' HG13 ' A' ' 33' ' ' VAL . 23.0 t70 -71.09 144.11 50.42 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 173.299 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.437 ' HA ' HG13 ' A' ' 90' ' ' ILE . 50.2 p -71.98 -35.65 69.57 Favored 'General case' 0 C--N 1.277 -2.578 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.337 -171.699 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 17.0 mmm180 -80.75 -26.53 37.25 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 120.356 -0.538 . . . . 0.0 109.705 -174.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.479 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 67.1 t90 -65.99 -46.89 76.4 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 107.622 -1.251 . . . . 0.0 107.622 177.348 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.441 ' CG ' HD11 ' A' ' 90' ' ' ILE . 33.8 t80 -65.89 -37.65 86.67 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.329 179.488 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.475 ' HA ' ' HD3' ' A' ' 42' ' ' LYS . 94.6 mttt -67.03 -29.76 69.66 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 176.169 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.479 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 22.2 tp60 -66.78 -45.91 76.97 Favored 'General case' 0 N--CA 1.406 -2.67 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 173.007 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 67.4 t90 -59.83 -41.54 91.55 Favored 'General case' 0 C--O 1.213 -0.828 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.649 176.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.528 ' HG2' ' CD1' ' A' ' 47' ' ' PHE . 15.2 mtpp -56.73 -38.19 72.04 Favored 'General case' 0 N--CA 1.44 -0.947 0 C-N-CA 123.252 0.621 . . . . 0.0 112.298 -179.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.435 ' HD3' ' NE2' ' A' ' 54' ' ' GLN . 44.1 mttp -76.54 -37.95 55.84 Favored 'General case' 0 C--N 1.281 -2.391 0 CA-C-N 116.004 -0.543 . . . . 0.0 112.251 178.589 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.546 ' O ' ' HA ' ' A' ' 55' ' ' MET . 0.0 OUTLIER -69.03 -35.57 76.76 Favored 'General case' 0 N--CA 1.412 -2.343 0 CA-C-N 114.857 -1.065 . . . . 0.0 109.59 -179.746 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.497 ' CG1' ' HB2' ' A' ' 47' ' ' PHE . 2.5 p -89.93 -22.28 6.46 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.654 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -177.223 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . 0.46 ' HA3' ' HB2' ' A' ' 52' ' ' LYS . . . 87.67 28.84 23.01 Favored Glycine 0 N--CA 1.435 -1.41 0 C-N-CA 121.122 -0.561 . . . . 0.0 112.446 -174.269 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.528 ' CD1' ' HG2' ' A' ' 42' ' ' LYS . 32.7 t80 -77.44 -35.67 53.74 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 177.703 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.45 ' HB2' ' O ' ' A' ' 51' ' ' ASP . 26.6 m-20 -76.76 103.48 6.74 Favored 'General case' 0 CA--C 1.491 -1.315 0 N-CA-C 106.061 -1.829 . . . . 0.0 106.061 172.596 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 9.2 m -54.61 -32.18 58.36 Favored 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 -176.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 45.7 p90 -95.5 -9.32 32.82 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.26 -178.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.45 ' O ' ' HB2' ' A' ' 48' ' ' ASP . 17.5 t0 -139.94 83.85 1.94 Allowed 'General case' 0 CA--C 1.487 -1.447 0 CA-C-O 122.398 1.094 . . . . 0.0 109.27 -175.349 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.46 ' HB2' ' HA3' ' A' ' 46' ' ' GLY . 55.4 pttt -145.93 16.31 1.39 Allowed 'General case' 0 N--CA 1.409 -2.504 0 CA-C-N 113.819 -1.537 . . . . 0.0 111.226 -173.828 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 19.9 p90 -69.11 -7.53 36.96 Favored 'General case' 0 C--N 1.285 -2.212 0 CA-C-N 114.589 -1.187 . . . . 0.0 111.115 173.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.435 ' NE2' ' HD3' ' A' ' 43' ' ' LYS . 19.7 mt-30 -102.75 12.0 36.85 Favored 'General case' 0 N--CA 1.41 -2.454 0 CA-C-N 114.591 -1.186 . . . . 0.0 109.679 -178.683 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' MET . . . . . 0.546 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 33.1 ttm -60.49 113.84 2.64 Favored 'General case' 0 N--CA 1.422 -1.835 0 CA-C-O 121.698 0.761 . . . . 0.0 111.898 -179.594 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 74.25 18.87 79.87 Favored Glycine 0 N--CA 1.431 -1.69 0 CA-C-N 114.736 -1.12 . . . . 0.0 111.558 -178.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.475 ' HB3' HG23 ' A' ' 60' ' ' VAL . 4.5 t0 -88.13 145.45 25.92 Favored 'General case' 0 CA--C 1.493 -1.215 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 -177.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.44 ' O ' ' HD1' ' A' ' 61' ' ' TYR . 11.5 pt20 -83.8 -8.66 59.18 Favored 'General case' 0 C--N 1.283 -2.313 0 CA-C-O 122.329 1.062 . . . . 0.0 110.535 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -72.99 -20.42 61.02 Favored 'General case' 0 C--N 1.288 -2.092 0 CA-C-N 114.419 -1.264 . . . . 0.0 111.003 173.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.49 HG21 ' HB2' ' A' ' 44' ' ' TYR . 35.4 m -128.1 7.9 3.07 Favored 'Isoleucine or valine' 0 CA--C 1.478 -1.805 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.375 -175.229 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.471 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 2.8 p90 -63.8 115.73 21.11 Favored Pre-proline 0 C--N 1.299 -1.593 0 O-C-N 124.098 0.874 . . . . 0.0 109.39 179.492 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.471 ' HD3' ' HA ' ' A' ' 61' ' ' TYR . 9.3 Cg_endo -87.19 111.86 0.87 Allowed 'Trans proline' 0 N--CA 1.417 -2.972 0 C-N-CA 122.37 2.046 . . . . 0.0 109.562 178.721 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -67.98 -147.19 0.14 Allowed Glycine 0 C--N 1.287 -2.162 0 CA-C-N 114.94 -1.027 . . . . 0.0 112.69 176.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -57.76 136.49 75.77 Favored 'Trans proline' 0 C--O 1.249 1.065 0 C-N-CA 122.101 1.868 . . . . 0.0 112.315 -177.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.46 HG12 ' CZ2' ' A' ' 37' ' ' TRP . 61.1 mt -62.79 110.17 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.074 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.912 -177.652 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -102.85 118.65 37.3 Favored 'General case' 0 C--N 1.299 -1.617 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.719 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -94.87 17.88 12.9 Favored 'General case' 0 C--N 1.296 -1.721 0 CA-C-N 115.71 -0.677 . . . . 0.0 112.615 179.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 19.4 m -79.67 24.57 0.37 Allowed 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 -176.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -111.94 -21.7 6.24 Favored Glycine 0 CA--C 1.496 -1.104 0 N-CA-C 108.702 -1.759 . . . . 0.0 108.702 175.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.549 ' CD1' ' HB3' ' A' ' 89' ' ' TYR . 0.2 OUTLIER -102.72 -42.36 5.91 Favored 'General case' 0 N--CA 1.423 -1.791 0 CA-C-N 113.006 -1.597 . . . . 0.0 108.376 -173.45 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.41 HD12 ' CA ' ' A' ' 76' ' ' ALA . 91.2 mt -65.91 150.54 48.46 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-N 113.926 -1.488 . . . . 0.0 109.229 174.37 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt . . . . . 0 C--N 1.296 -1.758 0 CA-C-O 122.049 0.928 . . . . 0.0 111.471 -176.24 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . 0.41 ' CA ' HD12 ' A' ' 71' ' ' LEU . . . . . . . . 0 CA--C 1.513 -0.449 0 CA-C-O 122.079 0.942 . . . . 0.0 110.301 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 20.1 mm-40 -120.45 5.91 10.64 Favored 'General case' 0 C--N 1.282 -2.339 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 53.9 m -119.39 124.29 46.22 Favored 'General case' 0 C--N 1.281 -2.408 0 CA-C-N 114.381 -1.282 . . . . 0.0 112.771 -173.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 82.6 mt -92.05 150.09 21.16 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.438 178.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -71.02 151.84 44.18 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.148 178.091 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -78.03 -23.54 48.16 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.798 -177.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 31.7 m170 -88.32 4.77 44.88 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -175.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.411 ' HB3' ' CE2' ' A' ' 89' ' ' TYR . 98.1 mt -65.71 133.38 50.94 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 114.497 1.295 . . . . 0.0 114.497 -173.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.419 HG22 HD11 ' A' ' 87' ' ' LEU . 43.0 mm -115.13 -178.91 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.086 0 N-CA-C 104.977 -2.231 . . . . 0.0 104.977 172.016 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.563 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 21.7 t70 -71.54 -134.53 0.01 OUTLIER 'General case' 0 CA--C 1.57 1.724 0 CA-C-O 117.515 -1.231 . . . . 0.0 110.564 -178.074 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.66 ' HA ' ' O ' ' A' ' 89' ' ' TYR . 3.0 pp20? -45.53 -19.41 0.05 OUTLIER 'General case' 0 N--CA 1.51 2.543 0 N-CA-C 116.117 1.895 . . . . 0.0 116.117 -174.699 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.419 HD11 HG22 ' A' ' 84' ' ' ILE . 23.4 mt -59.76 -50.44 73.84 Favored 'General case' 0 C--N 1.287 -2.138 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.467 172.64 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -101.53 -50.01 3.86 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-N 114.753 -1.112 . . . . 0.0 111.342 -178.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' TYR . . . . . 0.823 ' CG ' HD12 ' A' ' 32' ' ' LEU . 0.5 OUTLIER -141.16 -175.7 4.42 Favored 'General case' 0 C--O 1.163 -3.472 0 C-N-CA 122.885 0.474 . . . . 0.0 110.968 -175.04 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.441 HD11 ' CG ' ' A' ' 38' ' ' PHE . 7.1 mt -142.24 145.79 23.31 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.499 0 CA-C-N 118.943 0.792 . . . . 0.0 109.49 173.098 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.528 ' CD2' HD11 ' A' ' 32' ' ' LEU . 62.7 mt -109.72 133.58 52.96 Favored 'General case' 0 N--CA 1.405 -2.715 0 CA-C-N 114.662 -1.154 . . . . 0.0 111.841 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.404 HD23 ' N ' ' A' ' 92' ' ' LEU . 1.4 mm? -123.98 151.16 64.62 Favored Pre-proline 0 C--N 1.282 -2.332 0 CA-C-N 113.557 -1.656 . . . . 0.0 106.947 -177.57 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.599 ' CG ' ' HB3' ' A' ' 19' ' ' LEU . 11.1 Cg_endo -65.9 169.18 13.74 Favored 'Trans proline' 0 N--CA 1.443 -1.478 0 C-N-CA 121.937 1.758 . . . . 0.0 109.122 170.149 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.401 ' HA ' ' CE1' ' A' ' 31' ' ' TYR . 21.7 m -43.98 -48.35 8.66 Favored 'General case' 0 C--N 1.315 -0.917 0 O-C-N 123.518 0.512 . . . . 0.0 111.467 174.571 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -71.74 -34.69 69.73 Favored 'General case' 0 CA--C 1.491 -1.292 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.273 -176.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.509 ' O ' HD23 ' A' ' 100' ' ' LEU . . . -56.87 -62.26 6.56 Favored Glycine 0 N--CA 1.42 -2.389 0 N-CA-C 109.979 -1.248 . . . . 0.0 109.979 178.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.454 ' HB2' ' HB2' ' A' ' 31' ' ' TYR . 59.0 t-105 -50.75 -51.52 49.38 Favored 'General case' 0 N--CA 1.434 -1.227 0 C-N-CA 124.869 1.268 . . . . 0.0 110.215 176.184 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -49.15 -37.49 22.32 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 177.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 60.0 mttm -72.38 -51.67 19.43 Favored 'General case' 0 N--CA 1.416 -2.158 0 CA-C-O 119.434 -0.317 . . . . 0.0 110.386 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.509 HD23 ' O ' ' A' ' 96' ' ' GLY . 0.8 OUTLIER -56.94 -39.41 74.47 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.36 0.6 . . . . 0.0 111.504 179.09 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.485 ' O ' ' HA ' ' A' ' 105' ' ' THR . 53.7 t -72.26 -30.78 36.69 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.838 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.78 177.708 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 6.5 t -82.27 -24.96 34.47 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 121.07 -1.019 . . . . 0.0 108.889 -177.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' TRP . . . . . . . . . . . . . 47.2 m0 -83.64 -45.86 12.98 Favored 'General case' 0 N--CA 1.425 -1.683 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.598 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -131.42 7.64 4.56 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -175.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.485 ' HA ' ' O ' ' A' ' 101' ' ' VAL 0.304 35.2 p 57.77 168.37 0.04 OUTLIER 'General case' 0 N--CA 1.416 -2.139 0 N-CA-C 117.666 2.469 . . . . 0.0 117.666 -179.849 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -91.87 153.8 19.29 Favored 'General case' 0 C--N 1.291 -1.955 0 N-CA-C 105.781 -1.933 . . . . 0.0 105.781 -179.624 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 32.2 tpp -73.69 152.21 40.51 Favored 'General case' 0 N--CA 1.381 -3.913 0 CA-C-O 122.357 1.075 . . . . 0.0 110.887 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -63.6 135.31 56.7 Favored 'General case' 0 N--CA 1.395 -3.219 0 CA-C-N 112.979 -1.919 . . . . 0.0 110.006 179.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 80.25 5.77 89.55 Favored Glycine 0 N--CA 1.408 -3.203 0 CA-C-N 114.406 -1.27 . . . . 0.0 113.011 178.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -111.45 168.49 9.49 Favored 'General case' 0 CA--C 1.482 -1.64 0 CA-C-N 117.799 0.8 . . . . 0.0 110.975 177.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . 0.434 ' O ' HD11 ' A' ' 113' ' ' ILE . 7.5 mt-10 -142.87 144.4 29.31 Favored Pre-proline 0 C--N 1.276 -2.624 0 N-CA-C 106.511 -1.663 . . . . 0.0 106.511 -177.077 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_exo -58.58 122.76 12.19 Favored 'Trans proline' 0 CA--C 1.462 -3.101 0 C-N-CA 122.788 2.325 . . . . 0.0 112.773 -177.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.434 HD11 ' O ' ' A' ' 111' ' ' GLU . 3.2 mp -82.77 107.31 14.45 Favored 'Isoleucine or valine' 0 N--CA 1.383 -3.823 0 CA-C-N 113.248 -1.797 . . . . 0.0 107.052 175.586 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . 0.509 ' HB1' ' CG2' ' A' ' 29' ' ' THR . . . -92.46 124.95 36.87 Favored 'General case' 0 C--N 1.274 -2.7 0 CA-C-O 121.599 0.714 . . . . 0.0 109.44 177.454 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -127.78 124.06 36.75 Favored 'General case' 0 N--CA 1.401 -2.885 0 N-CA-C 105.403 -2.073 . . . . 0.0 105.403 -176.071 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -68.52 174.14 4.41 Favored 'General case' 0 C--N 1.29 -2.008 0 CA-C-O 121.651 0.738 . . . . 0.0 112.097 -177.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.68 HG12 ' O ' ' A' ' 25' ' ' ARG . 35.1 t . . . . . 0 C--N 1.306 -1.314 0 N-CA-C 105.633 -1.988 . . . . 0.0 105.633 169.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.441 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . . . . . . 0 CA--C 1.504 -0.8 0 CA-C-O 120.771 0.319 . . . . 0.0 111.031 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.611 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 16.5 t70 -72.84 146.67 46.08 Favored 'General case' 0 CA--C 1.481 -1.695 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 176.609 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -47.88 -48.74 31.23 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 124.65 1.18 . . . . 0.0 112.095 176.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -66.65 -37.58 85.11 Favored 'General case' 0 C--N 1.282 -2.341 0 CA-C-N 113.126 -1.852 . . . . 0.0 109.924 -178.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.441 ' CG2' ' HB1' ' A' ' 7' ' ' ALA . 3.4 m -65.37 -56.73 10.97 Favored 'General case' 0 N--CA 1.387 -3.576 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.548 177.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.611 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 76.5 mt-30 -44.55 -61.34 1.58 Allowed 'General case' 0 CA--C 1.508 -0.671 0 C-N-CA 125.035 1.334 . . . . 0.0 113.193 -173.664 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.46 ' HB3' ' CG2' ' A' ' 45' ' ' VAL . 0.0 OUTLIER -66.4 -35.34 80.07 Favored 'General case' 0 N--CA 1.432 -1.352 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 -174.6 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 33.1 t -77.75 -38.98 45.72 Favored 'General case' 0 C--N 1.28 -2.45 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.776 -178.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -65.62 -39.36 91.4 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 -177.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.568 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 34.8 mm -75.27 -39.64 42.54 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.383 0 CA-C-N 114.955 -1.02 . . . . 0.0 110.475 177.218 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.18 -33.66 72.52 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-O 121.531 0.681 . . . . 0.0 109.568 -178.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.48 ' HA ' ' HE2' ' A' ' 21' ' ' LYS . 1.0 OUTLIER -67.15 -31.33 71.68 Favored 'General case' 0 N--CA 1.407 -2.605 0 CA-C-N 114.25 -1.341 . . . . 0.0 112.153 178.791 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.413 ' HB3' ' HG2' ' A' ' 93' ' ' PRO . 71.3 mt -85.94 -16.97 36.7 Favored 'General case' 0 C--N 1.276 -2.59 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -177.705 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 11.0 mt -86.24 -24.42 26.03 Favored 'General case' 0 CA--C 1.502 -0.888 0 CA-C-O 121.231 0.539 . . . . 0.0 110.42 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.48 ' HE2' ' HA ' ' A' ' 18' ' ' THR . 39.6 pttt -86.74 -16.67 35.67 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.907 -171.57 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.4 m -55.33 137.56 47.45 Favored 'General case' 0 N--CA 1.402 -2.871 0 C-N-CA 125.662 1.585 . . . . 0.0 111.67 173.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.4 m -78.43 168.13 20.26 Favored 'General case' 0 N--CA 1.399 -2.994 0 CA-C-N 114.033 -1.44 . . . . 0.0 108.69 174.197 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.541 HD22 ' CZ2' ' A' ' 30' ' ' TRP 0.303 72.6 mt -74.69 138.47 42.84 Favored 'General case' 0 N--CA 1.397 -3.1 0 N-CA-C 116.321 1.971 . . . . 0.0 116.321 -173.812 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.434 ' HB2' ' HB2' ' A' ' 28' ' ' ASP . 7.4 mmm180 -81.54 -178.37 6.92 Favored 'General case' 0 C--N 1.29 -1.982 0 CA-C-N 111.288 -2.687 . . . . 0.0 107.746 -177.321 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 21.6 pttp -117.3 118.88 33.47 Favored 'General case' 0 C--N 1.292 -1.894 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 176.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 58.98 45.12 95.65 Favored Glycine 0 C--O 1.238 0.381 0 CA-C-O 121.479 0.488 . . . . 0.0 111.906 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.434 ' HB2' ' HB2' ' A' ' 25' ' ' ARG . 2.0 t0 -107.32 175.33 5.53 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 -177.81 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.416 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 31.2 m -119.19 123.41 44.29 Favored 'General case' 0 C--N 1.277 -2.581 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 179.694 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.541 ' CZ2' HD22 ' A' ' 24' ' ' LEU . 60.0 m95 -107.06 145.23 32.63 Favored 'General case' 0 C--N 1.279 -2.457 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 177.348 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.469 ' HB2' ' HB2' ' A' ' 97' ' ' TRP . 76.0 m-85 -109.01 127.58 54.21 Favored 'General case' 0 C--N 1.267 -3.01 0 CA-C-O 121.17 0.51 . . . . 0.0 110.933 -177.424 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.766 HD12 ' CD1' ' A' ' 89' ' ' TYR . 23.7 tp -88.33 134.06 33.91 Favored 'General case' 0 N--CA 1.379 -3.993 0 CA-C-N 114.095 -1.411 . . . . 0.0 114.514 -174.842 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 41.5 t -126.88 143.55 39.96 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.728 0 C-N-CA 126.64 1.976 . . . . 0.0 108.753 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.529 ' OD1' ' HB2' ' A' ' 36' ' ' ARG . 11.0 t70 -67.82 123.37 20.38 Favored 'General case' 0 C--N 1.307 -1.257 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 172.825 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 10.7 t -66.99 -24.26 66.02 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 120.664 0.269 . . . . 0.0 110.955 -172.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.529 ' HB2' ' OD1' ' A' ' 34' ' ' ASP . 13.9 mtm-85 -74.31 -25.23 59.45 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.241 0.544 . . . . 0.0 110.633 -177.159 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 69.5 t90 -72.74 -44.82 61.17 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 107.253 -1.388 . . . . 0.0 107.253 172.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.489 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 34.9 t80 -60.84 -37.84 83.42 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 114.773 -1.103 . . . . 0.0 110.798 178.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.414 ' HA ' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -52.65 -44.14 65.95 Favored 'General case' 0 C--N 1.352 0.714 0 N-CA-C 112.141 0.423 . . . . 0.0 112.141 174.026 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 22.0 tp60 -64.54 -43.39 94.13 Favored 'General case' 0 N--CA 1.423 -1.782 0 C-N-CA 123.127 0.571 . . . . 0.0 109.756 179.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.61 ' O ' HG21 ' A' ' 45' ' ' VAL . 74.0 t90 -60.3 -40.29 90.0 Favored 'General case' 0 N--CA 1.429 -1.513 0 CA-C-N 114.642 -1.163 . . . . 0.0 111.009 179.229 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.489 ' HG3' ' O ' ' A' ' 38' ' ' PHE . 34.0 mtmt -52.08 -46.28 65.14 Favored 'General case' 0 CA--C 1.494 -1.193 0 O-C-N 123.357 0.411 . . . . 0.0 111.955 -179.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 61.6 mttm -69.33 -45.22 69.98 Favored 'General case' 0 CA--C 1.479 -1.75 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.572 -176.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.448 ' O ' ' HA ' ' A' ' 55' ' ' MET . 0.2 OUTLIER -57.96 -33.01 68.4 Favored 'General case' 0 N--CA 1.424 -1.748 0 CA-C-N 115.287 -0.869 . . . . 0.0 112.782 179.487 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.61 HG21 ' O ' ' A' ' 41' ' ' TRP . 3.7 m -95.16 -17.21 7.12 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.194 0 N-CA-C 113.692 0.997 . . . . 0.0 113.692 178.734 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 78.32 39.47 22.55 Favored Glycine 0 C--N 1.302 -1.325 0 N-CA-C 109.139 -1.584 . . . . 0.0 109.139 -172.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.42 ' HB2' HG22 ' A' ' 45' ' ' VAL . 46.6 t80 -74.25 -37.6 63.73 Favored 'General case' 0 N--CA 1.439 -1.012 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 178.27 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -74.23 120.92 20.46 Favored 'General case' 0 CA--C 1.49 -1.343 0 N-CA-C 106.677 -1.601 . . . . 0.0 106.677 174.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' SER . . . . . 0.433 ' HA ' ' HE3' ' A' ' 52' ' ' LYS . 30.5 m -58.65 -31.47 68.18 Favored 'General case' 0 C--N 1.298 -1.66 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -177.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 46.2 p90 -86.21 -15.0 42.26 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.354 -178.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 45.6 t0 -122.8 95.27 4.56 Favored 'General case' 0 CA--C 1.487 -1.476 0 CA-C-O 122.489 1.138 . . . . 0.0 110.871 -174.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.433 ' HE3' ' HA ' ' A' ' 49' ' ' SER . 34.3 mmtp -119.51 5.35 11.1 Favored 'General case' 0 C--N 1.284 -2.244 0 CA-C-N 113.624 -1.625 . . . . 0.0 108.621 -178.119 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 84.1 m-85 -78.54 -27.04 45.85 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.787 -174.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.487 ' HB3' HG13 ' A' ' 60' ' ' VAL . 9.5 mm100 -92.81 -3.11 55.27 Favored 'General case' 0 N--CA 1.404 -2.726 0 CA-C-N 114.746 -1.116 . . . . 0.0 110.683 -176.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' MET . . . . . 0.448 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 45.4 ttm -60.73 115.46 3.67 Favored 'General case' 0 N--CA 1.423 -1.808 0 C-N-CA 122.535 0.334 . . . . 0.0 110.535 -178.315 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.86 16.99 80.29 Favored Glycine 0 N--CA 1.439 -1.143 0 CA-C-N 115.437 -0.802 . . . . 0.0 112.251 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.492 ' HB3' HG23 ' A' ' 60' ' ' VAL . 5.9 t0 -91.74 147.5 22.94 Favored 'General case' 0 CA--C 1.502 -0.876 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 -178.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -83.5 -18.69 37.6 Favored 'General case' 0 C--N 1.295 -1.804 0 CA-C-O 121.909 0.861 . . . . 0.0 108.893 178.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 76.9 m-20 -62.34 -21.32 65.21 Favored 'General case' 0 CA--C 1.504 -0.815 0 CA-C-N 114.654 -1.157 . . . . 0.0 111.705 178.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.492 HG23 ' HB3' ' A' ' 57' ' ' ASP . 27.3 m -122.98 15.0 5.41 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.629 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.944 -176.631 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.417 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 1.1 p90 -55.89 120.14 31.14 Favored Pre-proline 0 C--N 1.292 -1.905 0 O-C-N 124.477 1.11 . . . . 0.0 111.439 -178.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.426 ' HG3' ' HA ' ' A' ' 41' ' ' TRP . 6.9 Cg_endo -91.4 115.03 0.41 Allowed 'Trans proline' 0 N--CA 1.421 -2.759 0 C-N-CA 122.909 2.406 . . . . 0.0 110.377 172.46 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -75.82 -153.85 4.58 Favored Glycine 0 C--N 1.282 -2.447 0 CA-C-N 114.256 -1.338 . . . . 0.0 111.964 175.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.439 ' HA ' ' O ' ' A' ' 104' ' ' TYR . 31.9 Cg_exo -57.35 144.08 92.23 Favored 'Trans proline' 0 C--O 1.244 0.786 0 C-N-CA 122.883 2.389 . . . . 0.0 111.88 -179.121 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 68.4 mt -64.69 118.55 7.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.22 -176.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.418 ' HB2' ' HG3' ' A' ' 107' ' ' MET . 12.6 t70 -106.85 109.46 21.37 Favored 'General case' 0 N--CA 1.436 -1.157 0 O-C-N 123.461 0.475 . . . . 0.0 110.086 179.226 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.416 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 94.9 m-20 -100.9 11.65 39.17 Favored 'General case' 0 C--N 1.297 -1.686 0 CA-C-N 115.384 -0.825 . . . . 0.0 111.644 179.403 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 75.7 m -69.9 -16.86 63.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.019 0.438 . . . . 0.0 111.089 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -72.75 -19.0 79.1 Favored Glycine 0 N--CA 1.44 -1.074 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 175.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.451 ' CD2' ' HB3' ' A' ' 89' ' ' TYR . 74.6 mt -96.06 -35.07 11.5 Favored 'General case' 0 CA--C 1.496 -1.134 0 CA-C-O 121.262 0.553 . . . . 0.0 109.623 177.483 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.465 HD12 ' CA ' ' A' ' 76' ' ' ALA . 87.8 mt -69.81 150.02 47.3 Favored 'General case' 0 N--CA 1.425 -1.691 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.198 -178.821 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 47.1 mtpt . . . . . 0 C--N 1.305 -1.344 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 -173.404 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . 0.465 ' CA ' HD12 ' A' ' 71' ' ' LEU . . . . . . . . 0 N--CA 1.444 -0.736 0 CA-C-O 121.957 0.884 . . . . 0.0 110.207 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 16.9 mm-40 -123.42 4.07 9.07 Favored 'General case' 0 C--N 1.281 -2.38 0 N-CA-C 107.598 -1.26 . . . . 0.0 107.598 -178.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.441 ' O ' ' HA ' ' A' ' 71' ' ' LEU . 70.7 m -132.6 131.93 41.97 Favored 'General case' 0 C--N 1.286 -2.153 0 CA-C-N 114.296 -1.32 . . . . 0.0 112.368 -173.166 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 36.7 tp -94.97 143.92 26.09 Favored 'General case' 0 N--CA 1.389 -3.524 0 C-N-CA 125.438 1.495 . . . . 0.0 108.706 -178.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 56.1 mtmt -66.94 158.15 31.52 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 -178.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -69.81 -49.91 48.09 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 114.336 1.236 . . . . 0.0 114.336 -167.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 29.9 m170 -93.48 12.01 26.57 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.439 0.903 . . . . 0.0 113.439 -170.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 16.3 mt -72.69 130.38 40.39 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-O 121.701 0.762 . . . . 0.0 112.555 -174.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.427 HG22 HD11 ' A' ' 87' ' ' LEU . 50.7 mm -101.19 175.13 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.935 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 -179.566 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.576 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 6.3 p-10 -64.59 -141.15 0.0 OUTLIER 'General case' 0 C--O 1.2 -1.538 0 C-N-CA 124.915 1.286 . . . . 0.0 112.158 -177.601 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.55 ' HA ' ' O ' ' A' ' 89' ' ' TYR . 0.0 OUTLIER -40.88 -19.9 0.01 OUTLIER 'General case' 0 N--CA 1.516 2.868 0 N-CA-C 115.804 1.779 . . . . 0.0 115.804 -173.865 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.427 HD11 HG22 ' A' ' 84' ' ' ILE . 15.2 mt -58.4 -53.52 57.41 Favored 'General case' 0 C--N 1.29 -2.017 0 C-N-CA 124.056 0.943 . . . . 0.0 109.88 171.618 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -107.11 -40.57 5.39 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.266 0.555 . . . . 0.0 111.138 -178.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' TYR . . . . . 0.766 ' CD1' HD12 ' A' ' 32' ' ' LEU . 1.8 p90 -140.31 174.13 10.82 Favored 'General case' 0 C--O 1.159 -3.671 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.832 -175.091 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.424 ' O ' HD13 ' A' ' 32' ' ' LEU . 6.0 mt -138.81 143.83 31.13 Favored 'Isoleucine or valine' 0 CA--C 1.481 -1.709 0 O-C-N 120.899 -1.126 . . . . 0.0 110.811 178.054 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.487 ' CD2' HD11 ' A' ' 32' ' ' LEU . 57.5 mt -106.24 128.11 53.72 Favored 'General case' 0 N--CA 1.404 -2.738 0 CA-C-N 114.183 -1.371 . . . . 0.0 111.838 177.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -115.92 149.75 43.8 Favored Pre-proline 0 C--N 1.272 -2.799 0 CA-C-N 113.064 -1.88 . . . . 0.0 106.236 -178.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.413 ' HG2' ' HB3' ' A' ' 19' ' ' LEU . 38.8 Cg_exo -65.36 169.13 12.97 Favored 'Trans proline' 0 N--CA 1.439 -1.679 0 N-CA-C 107.782 -1.661 . . . . 0.0 107.782 168.071 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 10.4 m -40.38 -47.96 2.64 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 123.928 0.767 . . . . 0.0 110.633 172.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -68.06 -39.8 82.93 Favored 'General case' 0 C--O 1.208 -1.129 0 CA-C-N 114.637 -1.165 . . . . 0.0 112.047 -175.054 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.435 ' O ' ' HB2' ' A' ' 99' ' ' LYS . . . -61.19 -52.89 48.96 Favored Glycine 0 N--CA 1.433 -1.518 0 N-CA-C 110.619 -0.992 . . . . 0.0 110.619 -178.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.469 ' HB2' ' HB2' ' A' ' 31' ' ' TYR . 69.5 t-105 -55.66 -53.33 57.81 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 123.596 0.758 . . . . 0.0 110.273 174.872 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 97.0 m-20 -46.86 -41.47 15.77 Favored 'General case' 0 C--O 1.199 -1.591 0 C-N-CA 123.349 0.66 . . . . 0.0 111.688 176.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.435 ' HB2' ' O ' ' A' ' 96' ' ' GLY . 41.6 mttm -64.46 -53.88 41.34 Favored 'General case' 0 CA--C 1.477 -1.862 0 CA-C-O 121.553 0.692 . . . . 0.0 109.989 -178.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 96' ' ' GLY . 77.8 mt -65.53 -33.42 75.88 Favored 'General case' 0 C--N 1.265 -3.096 0 CA-C-N 114.502 -1.226 . . . . 0.0 112.694 -176.148 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.4 ' O ' ' HA ' ' A' ' 105' ' ' THR . 48.1 t -79.64 -25.81 12.37 Favored 'Isoleucine or valine' 0 N--CA 1.4 -2.956 0 CA-C-O 121.494 0.664 . . . . 0.0 110.864 176.04 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 62.4 m -76.2 -38.04 57.01 Favored 'General case' 0 N--CA 1.419 -1.998 0 O-C-N 121.189 -0.944 . . . . 0.0 109.621 175.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' TRP . . . . . 0.42 ' CH2' ' HA ' ' A' ' 12' ' ' GLN . 28.8 m0 -82.17 -44.13 16.82 Favored 'General case' 0 N--CA 1.435 -1.215 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.424 -177.295 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' TYR . . . . . 0.439 ' O ' ' HA ' ' A' ' 64' ' ' PRO . 36.7 m-85 -119.95 -12.12 9.2 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -172.431 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.4 ' HA ' ' O ' ' A' ' 101' ' ' VAL 0.333 11.7 t 53.63 -174.44 0.03 OUTLIER 'General case' 0 C--O 1.24 0.604 0 C-N-CA 126.501 1.92 . . . . 0.0 114.009 -172.9 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -105.32 148.33 27.16 Favored 'General case' 0 C--N 1.248 -3.848 0 CA-C-N 113.425 -1.716 . . . . 0.0 109.212 -171.694 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' MET . . . . . 0.418 ' HG3' ' HB2' ' A' ' 66' ' ' ASP . 68.4 mmm -73.13 156.92 38.16 Favored 'General case' 0 CA--C 1.504 -0.822 0 CA-C-O 120.926 0.393 . . . . 0.0 111.503 175.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -61.17 148.37 40.99 Favored 'General case' 0 C--N 1.31 -1.12 0 C-N-CA 124.55 1.14 . . . . 0.0 112.011 -179.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 78.49 -23.89 2.77 Favored Glycine 0 N--CA 1.432 -1.588 0 CA-C-N 114.535 -1.212 . . . . 0.0 113.551 175.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -85.37 159.39 20.01 Favored 'General case' 0 N--CA 1.426 -1.661 0 CA-C-O 121.672 0.748 . . . . 0.0 111.175 -176.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -134.98 156.03 78.73 Favored Pre-proline 0 C--N 1.273 -2.743 0 N-CA-C 106.303 -1.74 . . . . 0.0 106.303 175.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -58.36 122.44 11.68 Favored 'Trans proline' 0 CA--C 1.469 -2.726 0 C-N-CA 122.431 2.088 . . . . 0.0 111.159 176.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.476 ' HB ' ' HB3' ' A' ' 32' ' ' LEU . 63.0 mt -84.42 106.63 14.8 Favored 'Isoleucine or valine' 0 N--CA 1.381 -3.879 0 CA-C-N 113.028 -1.896 . . . . 0.0 106.933 179.085 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . 0.416 ' HB1' ' CG2' ' A' ' 29' ' ' THR . . . -94.74 125.76 39.61 Favored 'General case' 0 C--N 1.27 -2.883 0 CA-C-O 121.725 0.774 . . . . 0.0 110.377 -179.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 10.1 tpt180 -125.72 115.05 19.47 Favored 'General case' 0 N--CA 1.4 -2.952 0 N-CA-C 105.31 -2.107 . . . . 0.0 105.31 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -73.53 166.19 23.69 Favored 'General case' 0 C--N 1.274 -2.683 0 C-N-CA 120.37 -0.532 . . . . 0.0 111.103 -179.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 87.3 t . . . . . 0 C--O 1.242 0.677 0 O-C-N 124.0 0.813 . . . . 0.0 109.595 178.758 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.413 ' HB2' ' CG2' ' A' ' 11' ' ' THR . . . . . . . . 0 N--CA 1.435 -1.216 0 CA-C-O 120.652 0.263 . . . . 0.0 110.806 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.687 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 25.0 t70 -70.58 146.27 50.21 Favored 'General case' 0 CA--C 1.465 -2.299 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 174.545 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 28.5 mt -53.79 -43.88 69.67 Favored 'General case' 0 CA--C 1.487 -1.454 0 CA-C-N 119.085 0.857 . . . . 0.0 111.166 -177.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -68.24 -24.19 64.88 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 114.897 -1.047 . . . . 0.0 110.094 -176.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.59 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 5.1 m -78.79 -50.77 10.75 Favored 'General case' 0 N--CA 1.38 -3.931 0 CA-C-N 114.498 -1.228 . . . . 0.0 109.462 175.092 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.687 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 52.0 mt-30 -49.16 -61.12 2.25 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.966 0.906 . . . . 0.0 112.298 -175.42 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -49.05 -43.43 40.79 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-O 121.701 0.763 . . . . 0.0 112.356 177.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.4 m -75.32 -34.6 61.25 Favored 'General case' 0 C--N 1.278 -2.534 0 CA-C-N 114.549 -1.205 . . . . 0.0 112.493 -176.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.5 t0 -77.08 -36.74 55.55 Favored 'General case' 0 C--N 1.3 -1.582 0 C-N-CA 123.786 0.834 . . . . 0.0 109.628 -177.01 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.562 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 27.3 mm -73.12 -33.05 41.13 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.244 0 C-N-CA 123.235 0.614 . . . . 0.0 110.468 177.056 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.34 -36.46 71.19 Favored 'General case' 0 CA--C 1.502 -0.89 0 O-C-N 123.855 0.722 . . . . 0.0 109.092 -178.019 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.48 ' O ' ' HG3' ' A' ' 21' ' ' LYS . 24.7 m -54.15 -57.12 12.32 Favored 'General case' 0 N--CA 1.405 -2.708 0 C-N-CA 125.757 1.623 . . . . 0.0 111.096 177.663 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.474 HD23 ' HB ' ' A' ' 18' ' ' THR . 2.7 mm? -66.81 -18.05 65.19 Favored 'General case' 1 N--CA 1.377 -4.099 0 N-CA-C 114.63 1.345 . . . . 0.0 114.63 -178.213 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.562 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 10.0 mt -84.43 -26.08 28.53 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-O 121.64 0.733 . . . . 0.0 109.442 178.593 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.48 ' HG3' ' O ' ' A' ' 18' ' ' THR . 0.0 OUTLIER -91.86 -7.57 48.95 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-N 114.667 -1.152 . . . . 0.0 110.822 -173.628 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 51.9 m -71.25 139.07 49.91 Favored 'General case' 0 N--CA 1.394 -3.275 0 CA-C-N 113.354 -1.748 . . . . 0.0 111.138 177.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 73.7 m -87.3 132.22 34.0 Favored 'General case' 0 N--CA 1.389 -3.501 0 CA-C-N 113.777 -1.556 . . . . 0.0 109.61 176.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.662 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP . 0.6 OUTLIER -80.21 160.09 25.73 Favored 'General case' 0 C--N 1.296 -1.756 0 N-CA-C 114.21 1.189 . . . . 0.0 114.21 -176.969 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.435 ' HD3' ' N ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -101.74 144.08 30.88 Favored 'General case' 0 C--N 1.295 -1.802 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 177.348 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -54.51 -22.2 12.24 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 116.649 2.092 . . . . 0.0 116.649 -169.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -134.7 33.53 2.47 Favored Glycine 0 C--N 1.293 -1.808 0 N-CA-C 110.409 -1.076 . . . . 0.0 110.409 -179.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -85.54 -177.17 6.36 Favored 'General case' 0 C--N 1.315 -0.933 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.285 -178.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.502 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 85.6 m -129.04 121.67 28.39 Favored 'General case' 0 N--CA 1.438 -1.061 0 CA-C-O 121.375 0.607 . . . . 0.0 110.249 -177.768 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.662 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 15.2 m95 -113.31 148.97 34.62 Favored 'General case' 0 N--CA 1.424 -1.767 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.35 -179.043 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 86.7 m-85 -106.68 142.68 35.94 Favored 'General case' 0 C--N 1.292 -1.922 0 C-N-CA 123.07 0.548 . . . . 0.0 111.385 -175.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.58 ' HA ' ' O ' ' A' ' 90' ' ' ILE . 6.2 mp -93.17 133.18 36.62 Favored 'General case' 0 CA--C 1.496 -1.096 0 CA-C-O 122.184 0.992 . . . . 0.0 113.606 -177.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.431 HG11 ' O ' ' A' ' 34' ' ' ASP . 53.4 t -117.06 142.45 30.89 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.484 0 N-CA-C 104.845 -2.28 . . . . 0.0 104.845 174.046 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.431 ' O ' HG11 ' A' ' 33' ' ' VAL . 4.5 t0 -67.28 127.7 33.65 Favored 'General case' 0 C--N 1.288 -2.078 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 172.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 6.5 t -66.46 -30.16 70.44 Favored 'General case' 0 N--CA 1.423 -1.789 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 -174.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 47.1 mtp85 -71.52 -29.78 65.17 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.149 -176.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.44 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 70.6 t90 -69.6 -46.96 65.09 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 173.824 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.483 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 28.9 t80 -61.53 -41.88 97.99 Favored 'General case' 0 C--O 1.212 -0.886 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.075 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.455 ' HA ' ' HE3' ' A' ' 42' ' ' LYS . 0.1 OUTLIER -55.5 -41.2 72.75 Favored 'General case' 0 N--CA 1.439 -1.004 0 O-C-N 122.007 -0.433 . . . . 0.0 111.855 175.091 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.44 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 21.5 tp60 -65.45 -42.38 92.4 Favored 'General case' 0 N--CA 1.423 -1.81 0 C-N-CA 123.495 0.718 . . . . 0.0 109.698 176.45 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 65.2 t90 -61.1 -39.98 92.01 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.592 177.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' A' ' 38' ' ' PHE . 8.3 mtmp? -56.99 -42.81 80.93 Favored 'General case' 0 CA--C 1.495 -1.17 0 CA-C-N 117.948 0.34 . . . . 0.0 110.991 -179.691 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.438 ' HB3' ' HB2' ' A' ' 54' ' ' GLN . 93.5 mttt -58.63 -52.14 66.95 Favored 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 124.175 0.922 . . . . 0.0 109.283 178.37 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.405 ' HB2' HG21 ' A' ' 60' ' ' VAL . 0.4 OUTLIER -65.55 -41.13 93.34 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-N 114.175 -1.375 . . . . 0.0 112.482 -172.48 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.405 ' CG1' ' HB2' ' A' ' 47' ' ' PHE . 3.7 p -90.47 -12.72 9.44 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.721 0 CA-C-N 116.313 -0.403 . . . . 0.0 112.026 -175.678 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . 0.547 ' HA3' ' CB ' ' A' ' 52' ' ' LYS . . . 64.23 45.32 93.89 Favored Glycine 0 N--CA 1.4 -3.72 0 C-N-CA 121.183 -0.532 . . . . 0.0 112.689 -171.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.405 ' HB2' ' CG1' ' A' ' 45' ' ' VAL . 94.5 t80 -66.44 -52.94 41.11 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 123.607 0.763 . . . . 0.0 112.002 -178.254 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.463 ' OD1' ' HB3' ' A' ' 42' ' ' LYS . 16.5 p-10 -99.08 99.64 10.68 Favored 'General case' 0 C--N 1.289 -2.051 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.923 -176.074 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 8.9 m -49.8 -29.73 8.41 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 125.547 1.539 . . . . 0.0 114.158 -176.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.409 ' CE2' ' HB2' ' A' ' 48' ' ' ASP . 49.1 p90 -72.56 -11.66 60.74 Favored 'General case' 0 C--N 1.322 -0.589 0 O-C-N 122.044 -0.41 . . . . 0.0 111.428 179.377 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.516 ' O ' ' HD2' ' A' ' 52' ' ' LYS . 20.1 t70 -129.26 -94.34 0.42 Allowed 'General case' 0 C--N 1.304 -1.387 0 CA-C-O 118.508 -0.758 . . . . 0.0 109.769 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.547 ' CB ' ' HA3' ' A' ' 46' ' ' GLY . 0.0 OUTLIER 42.8 29.11 0.15 Allowed 'General case' 0 CA--C 1.554 1.12 0 N-CA-C 116.392 1.997 . . . . 0.0 116.392 172.087 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 1.6 p90 -63.82 -5.08 3.77 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 115.407 1.632 . . . . 0.0 115.407 -173.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.438 ' HB2' ' HB3' ' A' ' 43' ' ' LYS . 11.2 mm100 -128.1 23.86 6.03 Favored 'General case' 0 C--N 1.285 -2.213 0 C-N-CA 124.015 0.926 . . . . 0.0 110.651 -171.321 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 50.4 ttm -57.0 108.26 0.49 Allowed 'General case' 0 N--CA 1.437 -1.098 0 C-N-CA 124.052 0.941 . . . . 0.0 110.784 -179.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.27 16.84 73.14 Favored Glycine 0 N--CA 1.434 -1.464 0 CA-C-N 115.855 -0.611 . . . . 0.0 112.299 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.514 ' HB3' HG23 ' A' ' 60' ' ' VAL . 7.6 t0 -86.97 148.56 25.27 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 178.405 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.466 ' O ' ' HD1' ' A' ' 61' ' ' TYR . 28.6 pt20 -85.19 -23.26 28.41 Favored 'General case' 0 C--N 1.292 -1.931 0 CA-C-O 121.493 0.663 . . . . 0.0 111.287 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 -62.04 -18.16 59.73 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-O 121.93 0.871 . . . . 0.0 111.699 -179.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.514 HG23 ' HB3' ' A' ' 57' ' ' ASP . 29.3 m -116.64 8.22 7.22 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.098 0 CA-C-N 115.028 -0.987 . . . . 0.0 112.225 -173.154 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.466 ' HD1' ' O ' ' A' ' 58' ' ' GLN . 2.8 p90 -60.37 116.85 19.62 Favored Pre-proline 0 C--N 1.308 -1.215 0 O-C-N 124.215 0.947 . . . . 0.0 110.681 -179.484 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 61' ' ' TYR . 7.7 Cg_endo -89.94 110.48 0.43 Allowed 'Trans proline' 0 N--CA 1.42 -2.818 0 C-N-CA 122.695 2.264 . . . . 0.0 109.39 175.411 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -69.66 -146.79 0.26 Allowed Glycine 0 C--N 1.291 -1.935 0 CA-C-N 115.03 -0.986 . . . . 0.0 112.879 177.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.654 ' HA ' ' O ' ' A' ' 104' ' ' TYR . 32.8 Cg_exo -55.34 134.47 64.06 Favored 'Trans proline' 0 C--O 1.247 0.94 0 C-N-CA 122.778 2.319 . . . . 0.0 112.2 -177.167 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 78.9 mt -62.29 125.14 18.12 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.039 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.433 -178.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.447 ' HB3' ' SD ' ' A' ' 107' ' ' MET . 7.1 p-10 -108.38 122.37 46.86 Favored 'General case' 0 N--CA 1.407 -2.602 0 CA-C-O 122.247 1.022 . . . . 0.0 109.222 177.797 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.551 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 13.4 m120 -100.52 9.65 42.26 Favored 'General case' 0 C--N 1.279 -2.47 0 N-CA-C 107.189 -1.412 . . . . 0.0 107.189 171.182 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 6.0 m -57.28 -34.25 68.47 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 124.965 1.306 . . . . 0.0 111.12 -178.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -77.91 -13.01 83.86 Favored Glycine 0 N--CA 1.438 -1.171 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.272 178.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 36.6 mt -100.03 -14.77 18.49 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 179.446 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.551 ' HG ' ' O ' ' A' ' 67' ' ' ASN . 99.6 mt -80.43 139.19 36.58 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.863 -178.426 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt . . . . . 0 C--N 1.309 -1.168 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.581 175.235 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . 0.411 ' HA ' HD11 ' A' ' 71' ' ' LEU . . . . . . . . 0 N--CA 1.437 -1.083 0 CA-C-O 121.898 0.856 . . . . 0.0 109.254 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 56.8 mm-40 -118.66 -2.63 10.93 Favored 'General case' 0 C--N 1.299 -1.61 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 24.2 p -90.87 116.89 29.04 Favored 'General case' 0 N--CA 1.424 -1.764 0 CA-C-N 113.854 -1.521 . . . . 0.0 109.729 -177.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 19.1 tp -98.29 138.86 34.93 Favored 'General case' 0 N--CA 1.39 -3.444 0 C-N-CA 124.371 1.068 . . . . 0.0 110.068 -176.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.461 ' HE2' ' O ' ' A' ' 71' ' ' LEU . 68.3 mttm -61.31 139.09 58.23 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.556 0.693 . . . . 0.0 111.26 177.593 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -89.28 -19.51 25.25 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-N 114.722 -1.126 . . . . 0.0 113.918 -168.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 28.5 m170 -86.28 -10.98 53.47 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -175.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 8.2 mp -76.77 139.2 40.32 Favored 'General case' 0 C--N 1.295 -1.768 0 N-CA-C 114.948 1.462 . . . . 0.0 114.948 -172.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.409 HG22 HD11 ' A' ' 84' ' ' ILE . 58.0 mt -101.05 178.06 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.426 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 176.339 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.727 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 12.2 t70 -64.87 -130.72 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.557 0 C-N-CA 124.372 1.069 . . . . 0.0 110.186 -177.295 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -38.43 -24.08 0.01 OUTLIER 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 127.585 2.354 . . . . 0.0 114.792 -179.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 18.6 mt -66.43 -47.5 73.03 Favored 'General case' 0 C--N 1.284 -2.28 0 C-N-CA 123.33 0.652 . . . . 0.0 110.821 177.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -113.63 -34.28 5.58 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.41 -175.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' TYR . . . . . 0.727 ' CE1' ' HA ' ' A' ' 85' ' ' ASP . 3.7 p90 -142.41 -163.87 1.7 Allowed 'General case' 0 C--O 1.187 -2.227 0 N-CA-C 106.315 -1.735 . . . . 0.0 106.315 -179.433 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.58 ' O ' ' HA ' ' A' ' 32' ' ' LEU . 4.7 mt -147.68 148.2 16.6 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.235 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 171.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.483 HD23 ' CD1' ' A' ' 32' ' ' LEU . 26.6 mt -109.81 126.2 53.54 Favored 'General case' 0 N--CA 1.397 -3.113 0 O-C-N 124.532 1.145 . . . . 0.0 111.476 175.329 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -118.86 149.51 46.74 Favored Pre-proline 0 C--N 1.306 -1.317 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.686 -177.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.469 ' HD2' ' HB3' ' A' ' 19' ' ' LEU . 50.0 Cg_exo -61.71 168.67 8.14 Favored 'Trans proline' 0 C--O 1.257 1.465 0 C-N-CA 122.051 1.834 . . . . 0.0 108.51 164.626 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 19.5 m -46.79 -41.01 14.74 Favored 'General case' 0 C--N 1.306 -1.321 0 O-C-N 123.607 0.567 . . . . 0.0 111.05 174.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 5.8 mp0 -61.96 -52.7 62.95 Favored 'General case' 0 CA--C 1.5 -0.95 0 C-N-CA 124.538 1.135 . . . . 0.0 111.046 -178.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.468 ' O ' ' HB2' ' A' ' 99' ' ' LYS . . . -56.07 -54.28 36.6 Favored Glycine 0 N--CA 1.429 -1.795 0 O-C-N 124.015 0.822 . . . . 0.0 111.848 -176.456 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 70.9 t-105 -55.65 -51.09 68.38 Favored 'General case' 0 N--CA 1.425 -1.724 0 C-N-CA 123.007 0.523 . . . . 0.0 111.312 176.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 -52.37 -34.97 50.21 Favored 'General case' 0 CA--C 1.485 -1.533 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 177.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.468 ' HB2' ' O ' ' A' ' 96' ' ' GLY . 54.2 mttm -67.01 -52.11 46.51 Favored 'General case' 0 CA--C 1.468 -2.21 0 CA-C-O 121.375 0.607 . . . . 0.0 110.419 178.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' A' ' 96' ' ' GLY . 69.1 mt -65.99 -35.92 81.89 Favored 'General case' 0 C--N 1.261 -3.25 0 CA-C-N 114.752 -1.113 . . . . 0.0 111.945 -175.683 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.445 ' O ' ' HA ' ' A' ' 105' ' ' THR . 18.6 t -77.59 -25.41 14.8 Favored 'Isoleucine or valine' 0 N--CA 1.399 -2.995 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.723 174.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 38.2 t -74.46 -38.22 63.02 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 176.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' TRP . . . . . 0.56 ' CZ3' ' HB3' ' A' ' 12' ' ' GLN . 36.7 m0 -77.85 -54.56 6.18 Favored 'General case' 0 N--CA 1.422 -1.834 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.201 -176.022 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' TYR . . . . . 0.654 ' O ' ' HA ' ' A' ' 64' ' ' PRO . 30.9 m-85 -127.88 13.21 6.82 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 114.255 1.206 . . . . 0.0 114.255 -175.505 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.445 ' HA ' ' O ' ' A' ' 101' ' ' VAL 0.252 10.0 t 47.28 -170.05 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 126.256 1.822 . . . . 0.0 115.473 178.755 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 52.6 tp -115.39 142.15 47.08 Favored 'General case' 0 C--N 1.26 -3.309 0 CA-C-N 113.29 -1.777 . . . . 0.0 109.006 -175.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' MET . . . . . 0.447 ' SD ' ' HB3' ' A' ' 66' ' ' ASP . 72.9 mtp -63.18 156.37 25.44 Favored 'General case' 0 CA--C 1.508 -0.656 0 CA-C-O 122.155 0.979 . . . . 0.0 113.621 178.6 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -71.53 147.66 47.5 Favored 'General case' 0 N--CA 1.413 -2.32 0 CA-C-N 113.967 -1.469 . . . . 0.0 111.533 178.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 94.76 -24.48 27.93 Favored Glycine 0 N--CA 1.418 -2.545 0 CA-C-N 114.926 -1.034 . . . . 0.0 113.504 175.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -113.65 169.86 8.67 Favored 'General case' 0 N--CA 1.421 -1.914 0 CA-C-O 120.698 0.285 . . . . 0.0 110.501 -177.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 65.8 mm-40 -137.1 155.57 76.01 Favored Pre-proline 0 C--N 1.301 -1.503 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 -177.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_exo -56.62 124.57 16.57 Favored 'Trans proline' 0 CA--C 1.463 -3.047 0 C-N-CA 123.498 2.798 . . . . 0.0 113.012 -177.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 2.6 mp -83.36 110.21 17.96 Favored 'Isoleucine or valine' 0 N--CA 1.384 -3.755 0 N-CA-C 106.534 -1.654 . . . . 0.0 106.534 175.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . 0.502 ' HB1' ' CG2' ' A' ' 29' ' ' THR . . . -107.13 132.85 52.56 Favored 'General case' 0 C--N 1.281 -2.387 0 CA-C-N 115.426 -0.806 . . . . 0.0 108.901 178.515 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.432 ' HB2' HD13 ' A' ' 32' ' ' LEU . 5.4 tpt180 -130.33 135.24 47.85 Favored 'General case' 0 N--CA 1.407 -2.616 0 N-CA-C 105.706 -1.961 . . . . 0.0 105.706 -178.505 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -84.23 168.58 15.6 Favored 'General case' 0 C--N 1.272 -2.792 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -175.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.429 HG22 ' O ' ' A' ' 25' ' ' ARG . 90.4 t . . . . . 0 N--CA 1.42 -1.967 0 CA-C-O 122.376 1.084 . . . . 0.0 111.177 -177.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.437 ' HB2' ' CG2' ' A' ' 11' ' ' THR . . . . . . . . 0 C--O 1.248 1.026 0 CA-C-O 120.92 0.391 . . . . 0.0 111.213 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.61 ' O ' ' HB ' ' A' ' 11' ' ' THR . 19.6 t70 -78.37 157.55 29.04 Favored 'General case' 0 C--O 1.178 -2.7 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 176.327 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.463 ' O ' ' HG3' ' A' ' 13' ' ' ARG . 32.5 mt -59.1 -33.89 71.36 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 118.945 0.793 . . . . 0.0 111.608 -177.065 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -73.13 -30.0 63.3 Favored 'General case' 0 C--N 1.281 -2.396 0 CA-C-N 114.003 -1.453 . . . . 0.0 108.965 -178.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.61 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 56.2 m -78.12 -49.74 13.33 Favored 'General case' 0 N--CA 1.382 -3.837 0 CA-C-N 113.887 -1.506 . . . . 0.0 110.233 177.332 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.533 ' HB3' ' CZ3' ' A' ' 103' ' ' TRP . 25.7 mt-30 -55.42 -57.29 12.47 Favored 'General case' 0 C--N 1.346 0.443 0 C-N-CA 123.171 0.588 . . . . 0.0 112.132 -172.243 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.463 ' HG3' ' O ' ' A' ' 9' ' ' LEU . 42.4 mtm-85 -44.64 -54.28 6.32 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-O 121.698 0.761 . . . . 0.0 109.896 177.657 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 59.7 m -65.63 -48.92 70.59 Favored 'General case' 0 N--CA 1.419 -2.004 0 CA-C-N 113.467 -1.697 . . . . 0.0 112.732 -172.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -66.54 -35.27 79.82 Favored 'General case' 0 C--N 1.314 -0.977 0 C-N-CA 124.169 0.988 . . . . 0.0 109.841 -175.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 30.4 mm -77.67 -44.53 29.17 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.303 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.769 176.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.15 -35.87 67.65 Favored 'General case' 0 CA--C 1.493 -1.239 0 CA-C-O 121.349 0.595 . . . . 0.0 109.558 -176.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 3.0 m -54.87 -42.77 72.47 Favored 'General case' 0 N--CA 1.394 -3.266 0 C-N-CA 126.017 1.727 . . . . 0.0 112.069 177.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 64.4 mt -83.7 -23.48 31.67 Favored 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -171.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.92 -26.46 68.32 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 122.046 0.927 . . . . 0.0 109.999 170.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -91.22 -36.15 14.1 Favored 'General case' 0 C--N 1.29 -1.984 0 CA-C-N 114.081 -1.418 . . . . 0.0 110.633 -173.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 93.5 m -47.35 139.32 6.57 Favored 'General case' 0 N--CA 1.409 -2.515 0 C-N-CA 125.086 1.354 . . . . 0.0 111.697 173.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.2 t -90.57 166.27 13.3 Favored 'General case' 0 N--CA 1.41 -2.444 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.001 -172.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.535 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP . 0.5 OUTLIER -119.23 166.43 12.99 Favored 'General case' 0 N--CA 1.413 -2.297 0 CA-C-N 115.018 -0.992 . . . . 0.0 113.443 -179.105 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.455 ' O ' HG23 ' A' ' 117' ' ' VAL . 32.7 mmm180 -139.07 138.72 37.36 Favored 'General case' 0 CA--C 1.489 -1.399 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 179.354 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -62.22 109.65 1.38 Allowed 'General case' 0 C--N 1.301 -1.513 0 CA-C-O 121.994 0.902 . . . . 0.0 113.227 -177.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 128.44 -16.86 5.92 Favored Glycine 0 N--CA 1.423 -2.177 0 CA-C-N 113.854 -1.521 . . . . 0.0 110.01 -174.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 39.2 t0 -73.16 155.58 39.48 Favored 'General case' 0 CA--C 1.502 -0.897 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 18.6 m -115.83 123.88 49.28 Favored 'General case' 0 C--N 1.28 -2.456 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 -177.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.535 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 15.9 m95 -112.97 162.36 15.95 Favored 'General case' 0 C--N 1.285 -2.198 0 N-CA-C 107.707 -1.22 . . . . 0.0 107.707 178.708 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.465 ' CD1' ' HA ' ' A' ' 94' ' ' THR . 52.2 m-85 -117.56 141.93 47.78 Favored 'General case' 0 C--N 1.274 -2.694 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.661 ' HA ' ' O ' ' A' ' 90' ' ' ILE 0.414 0.4 OUTLIER -106.36 132.05 52.85 Favored 'General case' 0 N--CA 1.424 -1.741 0 N-CA-C 114.385 1.254 . . . . 0.0 114.385 179.525 . . . . . . . . 4 4 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.428 HG11 ' O ' ' A' ' 34' ' ' ASP . 89.9 t -110.49 151.21 12.74 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.485 0 CA-C-N 112.403 -2.18 . . . . 0.0 106.4 -176.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.504 ' OD1' ' HG2' ' A' ' 36' ' ' ARG . 18.7 t0 -72.91 131.69 42.53 Favored 'General case' 0 C--N 1.296 -1.723 0 N-CA-C 106.895 -1.521 . . . . 0.0 106.895 171.411 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.4 t -71.94 -22.7 61.43 Favored 'General case' 0 N--CA 1.422 -1.864 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 -171.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.504 ' HG2' ' OD1' ' A' ' 34' ' ' ASP . 9.3 mmt-85 -70.49 -36.91 74.08 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.413 -177.346 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.411 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 71.5 t90 -70.94 -43.19 68.67 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 178.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.506 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 41.3 t80 -61.29 -41.83 97.63 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.096 179.024 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.457 ' O ' ' HG3' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -53.03 -45.58 68.06 Favored 'General case' 0 N--CA 1.425 -1.682 0 C-N-CA 122.426 0.29 . . . . 0.0 111.183 174.106 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.411 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 25.5 tp60 -64.09 -39.49 94.17 Favored 'General case' 0 N--CA 1.426 -1.661 0 C-N-CA 124.059 0.944 . . . . 0.0 110.74 179.039 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 65.6 t90 -61.35 -38.08 85.67 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.847 176.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.506 ' HG3' ' O ' ' A' ' 38' ' ' PHE . 33.1 mtmt -59.15 -41.06 87.45 Favored 'General case' 0 CA--C 1.5 -0.971 0 CA-C-O 120.712 0.291 . . . . 0.0 111.268 -179.049 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.529 ' HG2' ' OD2' ' A' ' 51' ' ' ASP . 18.5 mtpp -66.94 -36.58 82.55 Favored 'General case' 0 C--N 1.311 -1.109 0 CA-C-N 115.101 -0.954 . . . . 0.0 108.818 -176.416 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.614 ' O ' ' HA ' ' A' ' 55' ' ' MET . 0.1 OUTLIER -79.37 -36.46 39.22 Favored 'General case' 0 N--CA 1.436 -1.129 0 CA-C-N 114.504 -1.225 . . . . 0.0 111.876 -177.885 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.413 HG11 ' HG2' ' A' ' 13' ' ' ARG . 3.5 p -89.29 -18.63 7.75 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.087 0 O-C-N 121.973 -0.454 . . . . 0.0 111.896 -177.087 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . 0.49 ' HA3' ' HB2' ' A' ' 52' ' ' LYS . . . 81.93 34.11 25.16 Favored Glycine 0 N--CA 1.428 -1.887 0 N-CA-C 111.924 -0.47 . . . . 0.0 111.924 -176.363 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 35.6 t80 -68.86 -42.43 77.08 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 123.055 0.542 . . . . 0.0 110.204 -179.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -86.96 126.43 34.71 Favored 'General case' 0 CA--C 1.498 -1.056 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 177.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.3 m -60.3 -36.26 77.47 Favored 'General case' 0 C--N 1.304 -1.38 0 CA-C-O 121.014 0.435 . . . . 0.0 112.079 -178.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 45.5 p90 -91.36 -7.67 50.2 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.586 -177.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.529 ' OD2' ' HG2' ' A' ' 43' ' ' LYS . 28.7 t70 -136.88 85.44 2.14 Favored 'General case' 0 CA--C 1.485 -1.552 0 CA-C-O 122.014 0.911 . . . . 0.0 110.439 -177.168 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.49 ' HB2' ' HA3' ' A' ' 46' ' ' GLY . 64.3 pttt -160.5 13.05 0.11 Allowed 'General case' 0 N--CA 1.432 -1.362 0 CA-C-N 113.73 -1.577 . . . . 0.0 112.768 -173.561 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 43.2 m-85 -68.64 -3.86 13.43 Favored 'General case' 0 C--N 1.287 -2.125 0 CA-C-O 121.932 0.872 . . . . 0.0 109.254 176.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.406 HE21 ' HE3' ' A' ' 43' ' ' LYS . 0.4 OUTLIER -112.45 17.34 19.38 Favored 'General case' 0 N--CA 1.403 -2.79 0 CA-C-N 114.887 -1.051 . . . . 0.0 109.47 -177.309 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' MET . . . . . 0.614 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 51.6 ttp -62.83 105.11 0.62 Allowed 'General case' 0 N--CA 1.413 -2.289 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.561 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 74.99 29.31 60.94 Favored Glycine 0 N--CA 1.437 -1.269 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.124 -176.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -102.79 154.25 19.36 Favored 'General case' 0 N--CA 1.444 -0.732 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 -177.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 29.7 pt20 -83.27 -17.26 43.2 Favored 'General case' 0 C--N 1.301 -1.525 0 CA-C-O 121.709 0.766 . . . . 0.0 109.986 -177.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 28.0 m-80 -61.18 -24.01 66.0 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 114.784 -1.098 . . . . 0.0 111.959 179.05 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 22.2 m -117.61 -21.4 4.85 Favored 'Isoleucine or valine' 0 CA--C 1.457 -2.633 0 N-CA-C 113.094 0.776 . . . . 0.0 113.094 -176.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . 0.311 2.4 p90 -33.73 102.38 0.21 Allowed Pre-proline 0 CA--C 1.545 0.766 0 O-C-N 126.179 2.174 . . . . 0.0 114.901 -159.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -75.15 102.44 1.59 Allowed 'Trans proline' 0 N--CA 1.426 -2.469 0 C-N-CA 122.9 2.4 . . . . 0.0 110.384 176.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -73.42 -144.12 0.68 Allowed Glycine 0 C--N 1.28 -2.555 0 CA-C-N 114.078 -1.419 . . . . 0.0 112.624 176.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_exo -56.98 133.57 58.82 Favored 'Trans proline' 0 C--O 1.246 0.897 0 C-N-CA 122.926 2.417 . . . . 0.0 112.417 -177.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.504 ' O ' ' HG3' ' A' ' 107' ' ' MET . 54.8 mt -62.16 114.02 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.361 0 CA-C-N 114.966 -1.016 . . . . 0.0 110.47 -177.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.547 ' HB2' ' SD ' ' A' ' 107' ' ' MET . 7.9 t70 -97.98 113.94 25.93 Favored 'General case' 0 CA--C 1.489 -1.381 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 173.463 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.436 ' O ' HD21 ' A' ' 71' ' ' LEU . 13.6 m120 -89.85 -15.06 33.04 Favored 'General case' 0 C--N 1.286 -2.167 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.672 178.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 6.0 m -53.03 -18.2 1.91 Allowed 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 114.995 1.479 . . . . 0.0 114.995 -168.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -76.65 -3.01 77.87 Favored Glycine 0 CA--C 1.527 0.81 0 C-N-CA 120.932 -0.651 . . . . 0.0 113.107 -178.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 39.5 mt -107.44 -17.39 14.13 Favored 'General case' 0 C--O 1.243 0.734 0 CA-C-O 122.253 1.025 . . . . 0.0 109.335 -179.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.436 HD21 ' O ' ' A' ' 67' ' ' ASN . 2.7 mm? -84.01 163.8 19.71 Favored 'General case' 0 N--CA 1.401 -2.918 0 CA-C-N 113.679 -1.6 . . . . 0.0 112.198 -173.22 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.8 mttt . . . . . 0 C--N 1.301 -1.51 0 CA-C-N 114.527 -1.215 . . . . 0.0 113.444 -178.324 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.5 -0.95 0 CA-C-O 120.936 0.398 . . . . 0.0 110.711 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . 0.614 HE21 ' HA ' ' A' ' 77' ' ' GLN . 0.0 OUTLIER -118.91 -1.2 11.05 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-O 121.809 0.814 . . . . 0.0 109.787 177.591 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 50.5 m -100.66 108.73 20.68 Favored 'General case' 0 C--N 1.281 -2.409 0 CA-C-N 114.407 -1.269 . . . . 0.0 111.137 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 87.1 mt -73.62 153.87 39.99 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.335 -178.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.407 ' HB2' ' CD1' ' A' ' 83' ' ' LEU . 98.9 mttt -78.78 165.83 23.13 Favored 'General case' 0 N--CA 1.426 -1.633 0 C-N-CA 119.734 -0.787 . . . . 0.0 109.202 170.579 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -82.46 -58.87 2.74 Favored 'General case' 0 C--N 1.285 -2.238 0 N-CA-C 113.799 1.037 . . . . 0.0 113.799 -171.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -74.96 12.57 0.83 Allowed 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 116.692 2.108 . . . . 0.0 116.692 -168.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.407 ' CD1' ' HB2' ' A' ' 80' ' ' LYS . 8.1 mp -73.78 169.11 18.04 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-O 121.547 0.689 . . . . 0.0 111.884 176.295 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.431 HG22 HD11 ' A' ' 84' ' ' ILE . 48.3 mt -137.33 166.88 24.19 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.575 0 N-CA-C 105.747 -1.945 . . . . 0.0 105.747 -178.013 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.619 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 65.9 t0 -56.24 -142.56 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.405 0 C-N-CA 126.498 1.919 . . . . 0.0 110.082 178.682 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.489 ' HA ' ' O ' ' A' ' 89' ' ' TYR . 7.5 pt-20 -39.09 -19.03 0.01 OUTLIER 'General case' 0 N--CA 1.533 3.694 0 N-CA-C 116.663 2.097 . . . . 0.0 116.663 -172.737 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.401 ' N ' ' O ' ' A' ' 85' ' ' ASP . 14.5 mt -67.87 -53.95 22.7 Favored 'General case' 0 C--N 1.281 -2.372 0 C-N-CA 123.891 0.876 . . . . 0.0 110.478 175.459 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -108.44 -30.85 8.08 Favored 'General case' 0 C--O 1.216 -0.667 0 CA-C-O 121.4 0.619 . . . . 0.0 110.993 -175.057 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' TYR . . . . . 0.619 ' CE1' ' HA ' ' A' ' 85' ' ' ASP . 8.7 p90 -142.32 -168.81 2.81 Favored 'General case' 0 C--O 1.173 -2.934 0 N-CA-C 104.738 -2.319 . . . . 0.0 104.738 177.542 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.661 ' O ' ' HA ' ' A' ' 32' ' ' LEU . 2.4 mt -144.7 141.07 23.7 Favored 'Isoleucine or valine' 0 CA--C 1.458 -2.578 0 CA-C-N 121.425 1.92 . . . . 0.0 109.47 173.638 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.428 ' CD2' ' HB3' ' A' ' 32' ' ' LEU . 77.9 mt -107.33 132.03 53.57 Favored 'General case' 0 C--N 1.274 -2.696 0 O-C-N 124.619 1.2 . . . . 0.0 110.792 176.739 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 2.1 mp -141.67 156.65 66.15 Favored Pre-proline 0 C--N 1.276 -2.618 0 N-CA-C 106.8 -1.555 . . . . 0.0 106.8 -177.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -61.23 167.77 8.77 Favored 'Trans proline' 0 C--O 1.26 1.578 0 C-N-CA 122.028 1.819 . . . . 0.0 110.218 174.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.465 ' HA ' ' CD1' ' A' ' 31' ' ' TYR . 32.4 m -49.86 -42.42 47.6 Favored 'General case' 0 C--N 1.306 -1.321 0 O-C-N 123.901 0.751 . . . . 0.0 110.231 176.527 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.499 ' O ' ' HG3' ' A' ' 99' ' ' LYS . 6.3 mm-40 -58.88 -50.34 74.39 Favored 'General case' 0 C--O 1.198 -1.609 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.89 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.548 ' O ' HD23 ' A' ' 100' ' ' LEU . . . -50.45 -58.11 9.49 Favored Glycine 0 CA--C 1.492 -1.362 0 O-C-N 124.153 0.908 . . . . 0.0 111.555 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 66.7 t-105 -54.65 -49.5 70.41 Favored 'General case' 0 C--N 1.311 -1.077 0 C-N-CA 123.169 0.588 . . . . 0.0 110.934 177.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -55.36 -31.11 61.5 Favored 'General case' 0 CA--C 1.496 -1.105 0 C-N-CA 123.088 0.555 . . . . 0.0 112.431 177.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.517 ' HB3' ' CZ2' ' A' ' 103' ' ' TRP . 59.2 mttm -72.82 -51.4 19.04 Favored 'General case' 0 N--CA 1.411 -2.388 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 178.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.548 HD23 ' O ' ' A' ' 96' ' ' GLY . 0.6 OUTLIER -60.7 -39.25 87.83 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.426 0.632 . . . . 0.0 111.153 -179.563 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.478 ' HA ' ' HA ' ' A' ' 105' ' ' THR . 21.3 t -72.89 -28.14 26.32 Favored 'Isoleucine or valine' 0 N--CA 1.403 -2.823 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.774 177.514 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 18.6 t -76.04 -35.45 59.46 Favored 'General case' 0 C--N 1.297 -1.696 0 O-C-N 121.228 -0.92 . . . . 0.0 109.101 178.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' TRP . . . . . 0.533 ' CZ3' ' HB3' ' A' ' 12' ' ' GLN . 28.2 m0 -80.66 -48.44 12.61 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.02 -175.371 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -126.02 -2.14 7.1 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 114.185 1.18 . . . . 0.0 114.185 -177.118 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.478 ' HA ' ' HA ' ' A' ' 101' ' ' VAL 0.351 14.3 t 52.74 175.1 0.02 OUTLIER 'General case' 0 CA--C 1.509 -0.596 0 CA-C-O 123.688 1.708 . . . . 0.0 115.135 -175.59 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 54.4 tp -95.82 160.36 14.51 Favored 'General case' 1 C--N 1.231 -4.553 0 CA-C-N 111.941 -2.39 . . . . 0.0 107.072 -178.023 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' MET . . . . . 0.547 ' SD ' ' HB2' ' A' ' 66' ' ' ASP . 37.3 mtp -68.62 155.67 39.58 Favored 'General case' 0 CA--C 1.487 -1.479 0 C-N-CA 119.045 -1.062 . . . . 0.0 108.811 175.311 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -84.43 132.53 34.56 Favored 'General case' 0 C--N 1.258 -3.379 0 CA-C-N 115.446 -0.797 . . . . 0.0 113.059 177.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 111.68 -37.37 3.72 Favored Glycine 0 N--CA 1.397 -3.908 0 CA-C-N 114.068 -1.424 . . . . 0.0 110.875 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -93.38 159.69 15.14 Favored 'General case' 0 N--CA 1.422 -1.857 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 178.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . 0.534 ' HB2' ' OE1' ' A' ' 77' ' ' GLN . 45.3 mt-10 -131.65 154.13 81.73 Favored Pre-proline 0 C--N 1.285 -2.223 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 -177.137 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -54.04 142.43 65.46 Favored 'Trans proline' 0 CA--C 1.458 -3.321 0 C-N-CA 124.13 3.22 . . . . 0.0 114.521 -175.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.51 ' O ' HD22 ' A' ' 32' ' ' LEU . 2.7 mp -100.51 113.8 37.38 Favored 'Isoleucine or valine' 1 N--CA 1.367 -4.604 0 CA-C-N 113.844 -1.526 . . . . 0.0 107.267 175.035 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -100.09 139.51 35.65 Favored 'General case' 0 C--N 1.281 -2.391 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.745 176.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 19.2 tpt180 -134.09 129.3 35.79 Favored 'General case' 0 C--N 1.293 -1.876 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 -177.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -79.58 163.29 24.76 Favored 'General case' 0 C--N 1.28 -2.435 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.677 177.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.455 HG23 ' O ' ' A' ' 25' ' ' ARG . 57.4 t . . . . . 0 C--N 1.311 -1.09 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.797 175.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.501 ' HB2' ' CG ' ' A' ' 12' ' ' GLN . . . . . . . . 0 N--CA 1.438 -1.036 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.633 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 9.8 t70 -71.32 140.36 50.24 Favored 'General case' 0 N--CA 1.427 -1.582 0 N-CA-C 106.746 -1.575 . . . . 0.0 106.746 173.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 65.0 mt -54.29 -40.79 68.22 Favored 'General case' 0 C--N 1.305 -1.353 0 CA-C-O 121.232 0.539 . . . . 0.0 110.482 -179.112 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -65.12 -39.9 93.74 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 114.318 -1.31 . . . . 0.0 110.033 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.444 ' HB ' ' HB3' ' A' ' 8' ' ' ASP . 2.3 m -66.75 -49.53 65.67 Favored 'General case' 0 N--CA 1.401 -2.877 0 CA-C-N 114.829 -1.078 . . . . 0.0 109.578 179.663 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.633 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 23.9 mt-30 -56.35 -44.87 80.52 Favored 'General case' 0 CA--C 1.474 -1.957 0 CA-C-N 114.914 -1.039 . . . . 0.0 111.225 -179.052 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.704 ' HD3' ' CG2' ' A' ' 45' ' ' VAL 0.268 10.3 mmm180 -69.56 -30.77 68.65 Favored 'General case' 0 N--CA 1.405 -2.685 0 N-CA-C 115.092 1.516 . . . . 0.0 115.092 -177.193 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.8 t -78.92 -46.21 18.89 Favored 'General case' 0 C--N 1.261 -3.279 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 179.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.485 ' O ' ' HB ' ' A' ' 18' ' ' THR . 11.1 t0 -59.83 -48.15 82.86 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 124.016 0.926 . . . . 0.0 109.624 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.581 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 12.4 mm -72.5 -39.07 61.56 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.207 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.611 -177.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.53 ' O ' ' HG2' ' A' ' 21' ' ' LYS . . . -57.94 -35.11 70.66 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 177.657 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.565 ' HA ' ' CE ' ' A' ' 21' ' ' LYS . 1.8 m -64.94 -43.39 92.89 Favored 'General case' 0 N--CA 1.399 -2.986 0 CA-C-N 114.183 -1.372 . . . . 0.0 111.786 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.545 ' HB3' ' CG ' ' A' ' 93' ' ' PRO . 88.8 mt -75.31 -12.87 60.36 Favored 'General case' 0 C--N 1.268 -2.955 0 N-CA-C 113.207 0.817 . . . . 0.0 113.207 -175.891 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.581 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 17.5 mt -86.22 -29.17 23.37 Favored 'General case' 0 C--N 1.309 -1.185 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 176.283 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.565 ' CE ' ' HA ' ' A' ' 18' ' ' THR . 54.4 pttt -96.32 -18.75 19.75 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-N 115.516 -0.766 . . . . 0.0 111.511 -175.186 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.6 m -53.46 131.71 38.61 Favored 'General case' 0 N--CA 1.399 -3.005 0 CA-C-O 122.251 1.024 . . . . 0.0 111.254 170.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 59.5 m -65.67 141.24 58.44 Favored 'General case' 0 N--CA 1.406 -2.634 0 CA-C-N 113.355 -1.748 . . . . 0.0 112.527 -178.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -112.13 159.88 18.09 Favored 'General case' 0 N--CA 1.41 -2.455 0 CA-C-N 114.948 -1.023 . . . . 0.0 112.738 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 28.3 mmt85 -130.86 144.69 51.64 Favored 'General case' 0 C--N 1.288 -2.082 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.365 -177.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 18.0 pttm -66.12 97.03 0.35 Allowed 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 122.213 1.006 . . . . 0.0 109.56 177.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 147.43 -17.44 1.49 Allowed Glycine 0 N--CA 1.427 -1.909 0 CA-C-N 113.636 -1.62 . . . . 0.0 109.965 -172.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -77.42 145.65 37.04 Favored 'General case' 0 CA--C 1.499 -0.986 0 CA-C-O 120.855 0.36 . . . . 0.0 110.113 177.324 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 58.8 m -104.44 132.71 50.38 Favored 'General case' 0 C--N 1.293 -1.877 0 N-CA-C 107.518 -1.289 . . . . 0.0 107.518 176.172 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 22.6 m95 -121.83 143.8 49.2 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 -178.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -107.04 141.03 38.92 Favored 'General case' 0 C--N 1.28 -2.452 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.842 -174.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.533 ' HA ' ' O ' ' A' ' 90' ' ' ILE . 5.9 mp -93.21 135.64 34.22 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 122.048 0.927 . . . . 0.0 112.799 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.47 HG11 ' O ' ' A' ' 34' ' ' ASP . 73.7 t -116.14 136.8 51.94 Favored 'Isoleucine or valine' 0 C--N 1.28 -2.45 0 N-CA-C 105.776 -1.935 . . . . 0.0 105.776 171.478 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.522 ' OD1' ' HG2' ' A' ' 36' ' ' ARG . 19.7 t0 -63.19 126.94 29.06 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 169.008 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.572 ' OG ' ' HE3' ' A' ' 39' ' ' LYS . 48.4 t -67.88 -23.86 65.17 Favored 'General case' 0 C--N 1.287 -2.15 0 CA-C-N 115.311 -0.858 . . . . 0.0 109.831 -171.741 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.522 ' HG2' ' OD1' ' A' ' 34' ' ' ASP . 17.3 mmt-85 -62.24 -40.68 96.98 Favored 'General case' 0 C--O 1.239 0.52 0 N-CA-C 109.603 -0.518 . . . . 0.0 109.603 -178.168 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.45 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 51.4 t90 -68.34 -45.52 72.65 Favored 'General case' 0 C--O 1.227 -0.094 0 CA-C-N 115.304 -0.862 . . . . 0.0 108.784 179.197 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.422 ' CG ' HD11 ' A' ' 90' ' ' ILE . 17.8 t80 -65.65 -34.56 78.51 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.984 -177.06 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.572 ' HE3' ' OG ' ' A' ' 35' ' ' SER . 96.7 mttt -68.51 -32.73 72.89 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-O 120.707 0.289 . . . . 0.0 111.438 176.395 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.45 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 20.1 tp60 -67.66 -41.61 83.5 Favored 'General case' 0 N--CA 1.412 -2.346 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 174.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.462 ' CH2' ' HD2' ' A' ' 13' ' ' ARG . 52.8 t90 -65.67 -40.37 92.33 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 114.902 -1.044 . . . . 0.0 110.121 178.384 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.42 ' HD3' ' HA ' ' A' ' 39' ' ' LYS . 13.4 mtpp -52.06 -43.36 63.78 Favored 'General case' 0 C--O 1.216 -0.697 0 C-N-CA 124.408 1.083 . . . . 0.0 113.398 178.291 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 45.7 mttm -74.7 -40.89 61.07 Favored 'General case' 0 C--N 1.303 -1.422 0 C-N-CA 119.809 -0.756 . . . . 0.0 111.207 179.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.448 ' HB2' HG21 ' A' ' 60' ' ' VAL . 4.2 t80 -55.81 -33.92 64.88 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-N 114.389 -1.278 . . . . 0.0 111.933 179.752 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.704 ' CG2' ' HD3' ' A' ' 13' ' ' ARG . 3.4 m -94.41 -23.54 5.18 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.826 0 N-CA-C 112.608 0.595 . . . . 0.0 112.608 176.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . 0.448 ' CA ' ' HG3' ' A' ' 52' ' ' LYS . . . 81.83 38.82 12.85 Favored Glycine 1 N--CA 1.391 -4.339 0 C-N-CA 120.033 -1.079 . . . . 0.0 110.498 -172.887 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.472 ' CD1' ' CZ ' ' A' ' 13' ' ' ARG . 42.4 t80 -59.66 -49.4 77.89 Favored 'General case' 0 N--CA 1.433 -1.289 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 176.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -73.22 114.47 11.44 Favored 'General case' 0 N--CA 1.429 -1.519 0 CA-C-N 113.651 -1.613 . . . . 0.0 108.263 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 5.7 m -55.56 -27.44 49.09 Favored 'General case' 0 C--N 1.3 -1.571 0 C-N-CA 124.885 1.274 . . . . 0.0 113.206 -175.099 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 44.1 p90 -94.88 -0.91 53.61 Favored 'General case' 0 C--N 1.298 -1.661 0 O-C-N 122.153 -0.342 . . . . 0.0 111.097 -178.135 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -136.34 77.07 1.63 Allowed 'General case' 0 C--N 1.312 -1.028 0 C-N-CA 119.502 -0.879 . . . . 0.0 110.76 -173.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.448 ' HG3' ' CA ' ' A' ' 46' ' ' GLY . 0.0 OUTLIER -118.21 23.09 11.81 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-O 121.809 0.814 . . . . 0.0 111.523 177.029 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 74.4 m-85 -77.87 -22.59 49.56 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 176.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.531 ' HB3' HG12 ' A' ' 60' ' ' VAL . 11.1 mm100 -95.57 -0.68 51.71 Favored 'General case' 0 N--CA 1.419 -2.02 0 C-N-CA 124.733 1.213 . . . . 0.0 110.283 -179.02 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 53.4 ttp -66.18 115.72 6.48 Favored 'General case' 0 N--CA 1.419 -1.994 0 CA-C-O 121.34 0.59 . . . . 0.0 110.672 -176.184 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 79.15 12.73 83.7 Favored Glycine 0 N--CA 1.437 -1.285 0 CA-C-N 115.065 -0.971 . . . . 0.0 111.512 -179.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.522 ' HB3' HG23 ' A' ' 60' ' ' VAL . 5.4 t70 -87.06 146.4 26.1 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 -177.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.449 ' O ' ' HD2' ' A' ' 61' ' ' TYR . 4.6 pt20 -83.82 -21.51 32.07 Favored 'General case' 0 C--N 1.285 -2.211 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.827 -177.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -65.46 -22.86 66.8 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 121.654 0.74 . . . . 0.0 111.859 178.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.531 HG12 ' HB3' ' A' ' 54' ' ' GLN . 32.0 m -116.84 2.66 7.66 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.186 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.449 -173.965 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.449 ' HD2' ' O ' ' A' ' 58' ' ' GLN . 0.3 OUTLIER -68.78 118.32 59.68 Favored Pre-proline 0 C--N 1.313 -1.02 0 C-N-CA 120.115 -0.634 . . . . 0.0 109.969 -179.22 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -92.09 117.74 0.44 Allowed 'Trans proline' 0 N--CA 1.407 -3.563 0 C-N-CA 122.357 2.038 . . . . 0.0 110.455 176.103 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -74.54 -141.17 0.69 Allowed Glycine 0 C--N 1.268 -3.226 0 CA-C-N 114.158 -1.383 . . . . 0.0 111.949 175.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.545 ' HA ' ' O ' ' A' ' 104' ' ' TYR . 50.6 Cg_exo -53.69 131.56 44.65 Favored 'Trans proline' 0 C--O 1.251 1.133 0 C-N-CA 122.881 2.387 . . . . 0.0 113.041 -178.024 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 67.9 mt -60.99 122.76 12.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.381 -178.059 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -117.56 127.54 54.08 Favored 'General case' 0 C--N 1.297 -1.676 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.312 -179.574 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.456 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 93.5 m-20 -112.58 10.69 19.55 Favored 'General case' 0 C--N 1.301 -1.5 0 O-C-N 123.83 0.707 . . . . 0.0 111.104 -178.484 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 50.9 m -88.2 78.43 8.08 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 122.22 1.01 . . . . 0.0 111.621 -177.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 174.02 -37.77 0.12 Allowed Glycine 0 CA--C 1.48 -2.145 0 N-CA-C 104.91 -3.276 . . . . 0.0 104.91 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.441 HD23 ' CA ' ' A' ' 34' ' ' ASP . 28.8 tp -70.18 -45.6 66.37 Favored 'General case' 1 N--CA 1.374 -4.226 0 CA-C-N 112.221 -1.989 . . . . 0.0 107.769 168.866 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.528 ' O ' ' HE3' ' A' ' 80' ' ' LYS . 75.3 mt -71.05 159.75 34.16 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 114.643 -1.162 . . . . 0.0 109.64 175.254 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 41.8 mtpt . . . . . 0 C--N 1.323 -0.57 0 CA-C-O 120.776 0.322 . . . . 0.0 111.224 -178.328 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.512 -0.485 0 CA-C-O 121.768 0.794 . . . . 0.0 111.69 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 -130.02 2.78 4.81 Favored 'General case' 0 C--N 1.291 -1.937 0 N-CA-C 105.95 -1.87 . . . . 0.0 105.95 179.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.5 p -105.51 123.29 47.64 Favored 'General case' 0 C--N 1.293 -1.874 0 CA-C-N 114.107 -1.406 . . . . 0.0 113.074 -171.119 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 71.5 mt -93.72 138.54 31.82 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-O 120.736 0.303 . . . . 0.0 110.381 175.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.528 ' HE3' ' O ' ' A' ' 71' ' ' LEU . 99.1 mttt -72.35 139.87 48.15 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-O 121.32 0.581 . . . . 0.0 110.753 176.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -65.42 -18.17 65.1 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 122.011 0.91 . . . . 0.0 110.597 176.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 8.8 t-80 -82.82 -7.16 59.68 Favored 'General case' 0 C--N 1.296 -1.728 0 CA-C-N 114.169 -1.378 . . . . 0.0 110.676 -175.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.416 ' HG ' ' HB2' ' A' ' 80' ' ' LYS . 77.2 mt -76.35 130.48 38.14 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-O 121.148 0.499 . . . . 0.0 112.039 -175.613 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.462 HG22 HD11 ' A' ' 84' ' ' ILE . 50.9 mt -112.39 -179.37 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.29 -2.002 0 N-CA-C 105.645 -1.983 . . . . 0.0 105.645 173.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.662 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 13.0 t70 -63.83 -145.14 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.344 0 C-N-CA 124.737 1.215 . . . . 0.0 110.139 -179.342 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.587 ' HA ' ' O ' ' A' ' 89' ' ' TYR 0.254 0.0 OUTLIER -40.63 -17.69 0.01 OUTLIER 'General case' 0 N--CA 1.52 3.036 0 N-CA-C 117.006 2.225 . . . . 0.0 117.006 -175.147 . . . . . . . . 4 4 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.443 HD11 ' CG2' ' A' ' 84' ' ' ILE . 43.4 mt -59.03 -52.48 65.56 Favored 'General case' 0 C--N 1.277 -2.579 0 C-N-CA 123.471 0.708 . . . . 0.0 109.782 170.526 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -112.59 -40.5 4.06 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.987 -176.439 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' TYR . . . . . 0.662 ' CE1' ' HA ' ' A' ' 85' ' ' ASP . 0.8 OUTLIER -135.74 178.43 7.05 Favored 'General case' 0 C--O 1.17 -3.097 0 C-N-CA 119.84 -0.744 . . . . 0.0 109.606 -179.983 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.533 ' O ' ' HA ' ' A' ' 32' ' ' LEU . 6.8 mt -139.45 147.98 23.81 Favored 'Isoleucine or valine' 0 N--CA 1.404 -2.735 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 174.612 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 64.4 mt -109.72 129.54 55.6 Favored 'General case' 0 N--CA 1.399 -3.015 0 O-C-N 124.623 1.202 . . . . 0.0 111.008 178.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -123.43 150.03 59.74 Favored Pre-proline 0 C--N 1.27 -2.86 0 CA-C-N 113.419 -1.719 . . . . 0.0 106.47 -177.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.545 ' CG ' ' HB3' ' A' ' 19' ' ' LEU . 10.2 Cg_endo -64.95 168.34 13.94 Favored 'Trans proline' 0 N--CA 1.428 -2.332 0 N-CA-C 108.296 -1.463 . . . . 0.0 108.296 169.193 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 18.9 m -43.7 -48.12 7.88 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 123.667 0.604 . . . . 0.0 110.732 173.092 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -68.16 -36.39 79.55 Favored 'General case' 0 CA--C 1.485 -1.553 0 CA-C-N 115.509 -0.769 . . . . 0.0 112.401 -178.365 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -58.88 -57.89 17.45 Favored Glycine 0 N--CA 1.417 -2.632 0 N-CA-C 110.168 -1.173 . . . . 0.0 110.168 179.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.426 ' CE2' ' HB3' ' A' ' 112' ' ' PRO . 70.0 t-105 -54.63 -50.57 67.8 Favored 'General case' 0 N--CA 1.421 -1.893 0 C-N-CA 123.449 0.7 . . . . 0.0 110.611 174.822 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -50.59 -34.48 26.06 Favored 'General case' 0 C--O 1.215 -0.748 0 C-N-CA 123.029 0.532 . . . . 0.0 112.31 177.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.4 ' HE3' ' OD1' ' A' ' 15' ' ' ASP . 41.7 mttm -70.71 -50.02 40.79 Favored 'General case' 0 CA--C 1.456 -2.644 0 CA-C-O 120.862 0.363 . . . . 0.0 110.375 179.447 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.509 HD22 ' CE3' ' A' ' 103' ' ' TRP . 44.3 mt -65.64 -31.2 72.09 Favored 'General case' 0 C--N 1.264 -3.133 0 CA-C-N 115.078 -0.964 . . . . 0.0 111.804 -176.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.455 ' HA ' ' HA ' ' A' ' 105' ' ' THR . 12.7 t -81.06 -24.77 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.402 -2.847 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.319 174.752 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 37.6 t -76.35 -36.44 58.19 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 107.519 -1.289 . . . . 0.0 107.519 177.522 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' TRP . . . . . 0.509 ' CE3' HD22 ' A' ' 100' ' ' LEU . 50.0 m0 -80.9 -53.84 6.1 Favored 'General case' 0 N--CA 1.41 -2.445 0 CA-C-N 114.677 -1.147 . . . . 0.0 112.08 -177.16 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' TYR . . . . . 0.545 ' O ' ' HA ' ' A' ' 64' ' ' PRO . 41.6 m-85 -120.85 -3.38 9.7 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.521 -0.471 . . . . 0.0 112.187 -170.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.455 ' HA ' ' HA ' ' A' ' 101' ' ' VAL 0.265 7.2 t 50.02 -173.46 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.17 0 C-N-CA 126.591 1.956 . . . . 0.0 114.376 -174.132 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 44.9 tp -114.98 144.31 43.8 Favored 'General case' 0 C--N 1.256 -3.483 0 CA-C-N 113.578 -1.646 . . . . 0.0 109.458 -175.347 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' MET . . . . . 0.483 ' SD ' ' HB2' ' A' ' 64' ' ' PRO . 65.2 mmm -65.33 156.64 31.47 Favored 'General case' 0 C--O 1.247 0.958 0 CA-C-O 121.584 0.707 . . . . 0.0 110.928 176.682 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -79.83 138.04 37.11 Favored 'General case' 0 C--N 1.278 -2.541 0 CA-C-N 114.77 -1.105 . . . . 0.0 111.951 -176.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 101.63 -37.21 3.75 Favored Glycine 0 N--CA 1.415 -2.762 0 CA-C-N 114.754 -1.112 . . . . 0.0 110.384 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 24.5 mp0 -74.97 158.15 33.76 Favored 'General case' 0 CA--C 1.499 -0.991 0 CA-C-O 121.679 0.752 . . . . 0.0 112.043 178.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -116.83 157.57 45.96 Favored Pre-proline 0 N--CA 1.408 -2.536 0 N-CA-C 105.364 -2.087 . . . . 0.0 105.364 175.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . 0.426 ' HB3' ' CE2' ' A' ' 97' ' ' TRP . 13.8 Cg_exo -73.63 122.32 7.74 Favored 'Trans proline' 0 CA--C 1.451 -3.651 0 N-CA-C 108.047 -1.559 . . . . 0.0 108.047 166.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 3.6 mp -83.01 106.96 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.38 -3.956 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 -179.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . 0.401 ' O ' ' HD3' ' A' ' 115' ' ' ARG . . . -103.5 129.46 50.68 Favored 'General case' 0 N--CA 1.402 -2.841 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.861 -179.141 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.401 ' HD3' ' O ' ' A' ' 114' ' ' ALA . 21.9 mmt180 -131.23 -172.51 2.86 Favored 'General case' 0 C--N 1.286 -2.154 0 N-CA-C 105.475 -2.046 . . . . 0.0 105.475 177.787 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -130.11 176.35 8.16 Favored 'General case' 0 C--N 1.269 -2.911 0 C-N-CA 118.575 -1.25 . . . . 0.0 111.46 -177.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 61.6 t . . . . . 0 C--N 1.31 -1.118 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 173.63 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.499 -0.989 0 CA-C-O 121.458 0.647 . . . . 0.0 110.207 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.565 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 4.8 p-10 -84.46 153.54 23.29 Favored 'General case' 0 CA--C 1.455 -2.708 0 C-N-CA 118.988 -1.085 . . . . 0.0 109.324 173.598 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.462 ' O ' ' HG3' ' A' ' 13' ' ' ARG . 3.9 mm? -47.5 -46.16 27.01 Favored 'General case' 0 C--N 1.286 -2.19 0 C-N-CA 125.757 1.623 . . . . 0.0 112.1 -178.695 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -67.78 -36.66 80.85 Favored 'General case' 0 C--N 1.257 -3.419 0 CA-C-N 113.064 -1.88 . . . . 0.0 110.273 -177.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.7 m -67.82 -50.21 58.02 Favored 'General case' 0 N--CA 1.395 -3.189 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.393 176.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.565 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 87.8 mt-30 -50.92 -53.4 33.15 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 124.0 0.812 . . . . 0.0 111.387 -175.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.478 ' HG2' HG11 ' A' ' 45' ' ' VAL . 28.9 mtm180 -48.56 -60.04 3.02 Favored 'General case' 0 N--CA 1.487 1.416 0 CA-C-O 122.137 0.97 . . . . 0.0 110.676 176.777 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.9 m -65.26 -43.51 91.08 Favored 'General case' 0 N--CA 1.424 -1.727 0 CA-C-N 113.379 -1.737 . . . . 0.0 113.091 -171.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -68.22 -36.08 78.97 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.451 -176.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.5 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 22.9 mm -78.79 -37.77 20.65 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.158 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.248 177.253 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.2 -43.23 92.24 Favored 'General case' 0 CA--C 1.492 -1.279 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 179.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 2.3 m -55.43 -39.98 70.94 Favored 'General case' 0 N--CA 1.403 -2.775 0 C-N-CA 125.504 1.522 . . . . 0.0 111.543 178.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 78.5 mt -84.29 -13.89 51.25 Favored 'General case' 0 C--N 1.295 -1.799 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -174.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.5 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 59.7 mt -81.58 -17.54 47.97 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 175.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -104.01 -41.44 5.85 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.156 -1.384 . . . . 0.0 111.424 -175.035 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.4 t -46.31 167.29 0.02 OUTLIER 'General case' 0 C--O 1.242 0.702 0 C-N-CA 126.35 1.86 . . . . 0.0 114.81 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 61.5 m -61.25 127.06 29.68 Favored 'General case' 0 N--CA 1.389 -3.502 0 CA-C-N 111.697 -2.501 . . . . 0.0 112.286 179.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.483 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP . 0.3 OUTLIER -111.7 -18.49 12.75 Favored 'General case' 0 C--N 1.283 -2.289 0 CA-C-N 113.797 -1.547 . . . . 0.0 113.116 -177.969 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.612 ' O ' HG12 ' A' ' 117' ' ' VAL . 9.9 mtm180 60.17 -152.67 0.39 Allowed 'General case' 0 C--N 1.253 -3.627 0 CA-C-N 112.838 -1.983 . . . . 0.0 109.09 -178.314 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 57.7 mtmt -126.43 29.02 5.85 Favored 'General case' 0 C--N 1.292 -1.91 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 172.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -153.3 33.33 0.78 Allowed Glycine 0 N--CA 1.435 -1.368 0 CA-C-N 114.33 -1.305 . . . . 0.0 113.074 -179.084 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.415 ' H ' HG21 ' A' ' 117' ' ' VAL . 7.9 t70 -109.56 173.45 6.32 Favored 'General case' 0 N--CA 1.484 1.264 0 N-CA-C 106.954 -1.498 . . . . 0.0 106.954 177.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.412 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 85.9 m -122.19 121.19 36.27 Favored 'General case' 0 C--N 1.282 -2.331 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.483 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 17.4 m95 -103.31 126.74 50.63 Favored 'General case' 0 N--CA 1.388 -3.564 0 CA-C-N 114.662 -1.153 . . . . 0.0 109.388 -179.249 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -98.38 144.47 27.72 Favored 'General case' 0 C--N 1.272 -2.782 0 CA-C-N 115.065 -0.971 . . . . 0.0 110.975 -175.567 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.546 ' HA ' ' O ' ' A' ' 90' ' ' ILE . 6.1 mp -93.5 141.9 27.95 Favored 'General case' 0 N--CA 1.426 -1.665 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.971 -177.254 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.464 ' CG1' ' HB ' ' A' ' 90' ' ' ILE . 0.6 OUTLIER -133.11 142.24 42.62 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.756 0 CA-C-N 114.377 -1.283 . . . . 0.0 108.365 174.963 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.507 ' OD1' ' HB2' ' A' ' 36' ' ' ARG . 10.5 t70 -61.13 128.98 39.08 Favored 'General case' 0 C--N 1.305 -1.349 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 176.205 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.476 ' O ' ' HD3' ' A' ' 39' ' ' LYS . 19.5 p -61.58 -34.86 76.33 Favored 'General case' 0 C--O 1.209 -1.028 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 -173.721 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.507 ' HB2' ' OD1' ' A' ' 34' ' ' ASP . 0.0 OUTLIER -64.13 -36.7 84.88 Favored 'General case' 0 CA--C 1.482 -1.667 0 CA-C-O 121.23 0.538 . . . . 0.0 111.204 -176.564 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.499 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 51.1 t90 -63.32 -44.04 96.08 Favored 'General case' 0 C--N 1.287 -2.131 0 CA-C-N 113.992 -1.458 . . . . 0.0 108.266 178.164 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -69.64 -43.17 73.17 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.829 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.476 ' HD3' ' O ' ' A' ' 35' ' ' SER . 14.6 mptt -55.38 -32.74 62.86 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 122.601 0.361 . . . . 0.0 111.937 171.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.499 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 62.6 tp60 -72.32 -46.62 54.82 Favored 'General case' 0 N--CA 1.419 -2.016 0 C-N-CA 123.22 0.608 . . . . 0.0 109.464 176.727 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 72.6 t90 -58.4 -39.22 79.11 Favored 'General case' 0 C--O 1.213 -0.821 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.871 177.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.508 ' HG2' ' CD1' ' A' ' 47' ' ' PHE . 15.3 mtpp -56.39 -40.0 73.89 Favored 'General case' 0 N--CA 1.44 -0.942 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.417 ' HB3' ' HG3' ' A' ' 54' ' ' GLN . 39.6 mttp -72.31 -44.67 62.37 Favored 'General case' 0 C--N 1.293 -1.87 0 CA-C-O 121.133 0.492 . . . . 0.0 110.25 177.478 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.56 ' O ' ' HA ' ' A' ' 55' ' ' MET . 1.0 OUTLIER -58.12 -39.1 77.83 Favored 'General case' 0 N--CA 1.418 -2.072 0 CA-C-N 114.524 -1.217 . . . . 0.0 110.948 -179.226 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.523 ' CG1' ' HB2' ' A' ' 47' ' ' PHE . 2.6 p -92.25 -23.62 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.387 -3.615 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -175.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . 0.414 ' HA3' ' HG3' ' A' ' 52' ' ' LYS . . . 93.07 22.85 26.54 Favored Glycine 0 N--CA 1.433 -1.535 0 C-N-CA 120.077 -1.059 . . . . 0.0 111.14 -175.249 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.523 ' HB2' ' CG1' ' A' ' 45' ' ' VAL . 20.1 t80 -78.87 -30.81 45.23 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 177.298 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -76.57 111.75 12.39 Favored 'General case' 0 CA--C 1.483 -1.598 0 N-CA-C 106.096 -1.816 . . . . 0.0 106.096 173.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 2.5 p -65.27 -19.72 66.09 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 113.065 0.765 . . . . 0.0 113.065 -175.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 42.1 p90 -97.69 -0.47 45.46 Favored 'General case' 0 C--N 1.286 -2.195 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.446 178.463 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.444 ' OD1' ' HG2' ' A' ' 54' ' ' GLN . 20.4 t0 -141.63 91.9 2.41 Favored 'General case' 0 CA--C 1.491 -1.318 0 C-N-CA 118.738 -1.185 . . . . 0.0 111.208 -176.593 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.44 ' HZ1' ' HB2' ' A' ' 52' ' ' LYS . 0.1 OUTLIER -121.77 18.86 11.07 Favored 'General case' 0 C--N 1.291 -1.939 0 CA-C-O 121.639 0.733 . . . . 0.0 110.541 175.836 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -78.91 -33.36 45.59 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 176.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.466 ' HB3' HG13 ' A' ' 60' ' ' VAL . 10.3 mm100 -81.76 -3.85 54.86 Favored 'General case' 0 N--CA 1.42 -1.973 0 CA-C-N 113.854 -1.521 . . . . 0.0 110.863 -177.139 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' MET . . . . . 0.56 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 46.6 ttm -62.63 114.83 3.8 Favored 'General case' 0 N--CA 1.421 -1.918 0 C-N-CA 123.115 0.566 . . . . 0.0 111.149 -177.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.01 5.66 89.47 Favored Glycine 0 N--CA 1.434 -1.481 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.994 179.301 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -81.38 141.18 34.22 Favored 'General case' 0 CA--C 1.496 -1.122 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 -177.386 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.557 ' O ' ' HD2' ' A' ' 61' ' ' TYR . 11.9 pt20 -78.72 -20.34 50.28 Favored 'General case' 0 C--N 1.277 -2.567 0 CA-C-N 114.926 -1.033 . . . . 0.0 109.332 177.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -58.18 -29.97 66.06 Favored 'General case' 0 CA--C 1.497 -1.082 0 CA-C-O 121.939 0.876 . . . . 0.0 111.064 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.498 HG21 ' HB2' ' A' ' 44' ' ' TYR . 21.7 m -115.29 2.3 8.04 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.998 0 CA-C-N 114.744 -1.116 . . . . 0.0 112.253 -171.297 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.557 ' HD2' ' O ' ' A' ' 58' ' ' GLN . 1.8 p90 -54.51 116.68 11.36 Favored Pre-proline 0 C--N 1.306 -1.307 0 O-C-N 124.373 1.045 . . . . 0.0 111.594 -175.819 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 61' ' ' TYR . 9.0 Cg_endo -87.92 109.17 0.63 Allowed 'Trans proline' 0 N--CA 1.426 -2.469 0 C-N-CA 122.763 2.309 . . . . 0.0 109.833 176.456 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -74.28 -141.19 0.65 Allowed Glycine 0 C--N 1.283 -2.38 0 CA-C-N 114.662 -1.154 . . . . 0.0 113.023 177.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.64 129.16 33.57 Favored 'Trans proline' 0 C--O 1.24 0.584 0 C-N-CA 123.04 2.493 . . . . 0.0 113.346 -176.592 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.438 HD13 ' HB3' ' A' ' 100' ' ' LEU . 47.6 mt -65.55 114.17 2.71 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.067 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.469 -178.719 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -108.36 127.53 53.96 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-O 120.775 0.321 . . . . 0.0 110.502 178.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.458 HD22 ' HA ' ' A' ' 33' ' ' VAL . 15.2 m120 -113.09 6.37 17.56 Favored 'General case' 0 C--N 1.302 -1.487 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.396 -176.693 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 12.1 t -53.8 -32.99 54.63 Favored 'General case' 0 CA--C 1.557 1.233 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 -174.355 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -73.96 -14.79 79.99 Favored Glycine 0 CA--C 1.525 0.691 0 C-N-CA 121.202 -0.523 . . . . 0.0 112.703 -179.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.437 HD11 HD21 ' A' ' 67' ' ' ASN . 61.6 mt -89.67 -15.56 32.37 Favored 'General case' 0 C--O 1.243 0.755 0 CA-C-O 121.949 0.881 . . . . 0.0 109.273 -179.451 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.579 ' HA ' ' HA ' ' A' ' 79' ' ' LEU . 74.9 mt -86.45 161.44 18.63 Favored 'General case' 0 C--N 1.292 -1.929 0 CA-C-N 114.863 -1.062 . . . . 0.0 112.065 -173.005 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt . . . . . 0 C--N 1.308 -1.199 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 178.443 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.489 0 CA-C-O 122.135 0.969 . . . . 0.0 110.969 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 -114.82 -1.95 13.07 Favored 'General case' 0 C--N 1.286 -2.18 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 178.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.8 m -93.87 107.01 18.95 Favored 'General case' 0 C--N 1.296 -1.76 0 CA-C-N 114.247 -1.342 . . . . 0.0 108.541 -177.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.579 ' HA ' ' HA ' ' A' ' 71' ' ' LEU . 1.5 pp -107.91 154.76 21.13 Favored 'General case' 0 C--N 1.292 -1.925 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.433 -174.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.485 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 50.3 mtmt -66.27 112.38 3.95 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 122.052 0.929 . . . . 0.0 111.007 179.194 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -60.12 -27.85 67.38 Favored 'General case' 0 C--N 1.298 -1.656 0 C-N-CA 124.979 1.312 . . . . 0.0 112.781 -173.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 33.0 m170 -91.96 11.58 24.62 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 112.43 0.53 . . . . 0.0 112.43 -175.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 80' ' ' LYS . 61.5 mt -77.36 133.95 38.59 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-O 121.007 0.432 . . . . 0.0 111.266 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 42.8 mt -81.0 164.15 3.11 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.179 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 177.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.727 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 5.3 p-10 -64.39 -110.87 0.0 OUTLIER 'General case' 0 C--O 1.19 -2.079 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -176.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -44.11 -29.67 0.65 Allowed 'General case' 0 CA--C 1.557 1.232 0 C-N-CA 127.946 2.498 . . . . 0.0 113.466 -177.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 22.9 mt -72.57 -57.59 4.03 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.283 -178.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -86.55 -29.45 22.65 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.637 -176.044 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' TYR . . . . . 0.727 ' CE1' ' HA ' ' A' ' 85' ' ' ASP . 7.8 p90 -155.94 -163.06 1.41 Allowed 'General case' 0 C--O 1.194 -1.853 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 -175.386 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.546 ' O ' ' HA ' ' A' ' 32' ' ' LEU . 0.6 OUTLIER -136.74 148.48 26.79 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.085 0 N-CA-C 106.673 -1.603 . . . . 0.0 106.673 167.138 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.486 HD23 ' CD1' ' A' ' 32' ' ' LEU . 15.9 mt -107.33 123.49 48.42 Favored 'General case' 1 N--CA 1.367 -4.612 0 O-C-N 124.55 1.156 . . . . 0.0 109.24 169.688 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 12.0 mt -118.12 146.87 40.25 Favored Pre-proline 0 C--N 1.283 -2.318 0 N-CA-C 106.315 -1.735 . . . . 0.0 106.315 -178.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -71.17 169.56 20.34 Favored 'Trans proline' 0 C--O 1.259 1.574 0 C-N-CA 121.974 1.783 . . . . 0.0 108.109 176.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.583 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 98.6 m -38.96 -52.2 1.79 Allowed 'General case' 0 CA--C 1.543 0.675 0 O-C-N 123.991 0.807 . . . . 0.0 111.707 178.082 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -72.66 -30.95 64.71 Favored 'General case' 0 CA--C 1.498 -1.021 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 -175.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.57 ' O ' HD23 ' A' ' 100' ' ' LEU . . . -62.75 -55.05 29.21 Favored Glycine 0 N--CA 1.43 -1.722 0 N-CA-C 109.158 -1.577 . . . . 0.0 109.158 178.102 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.406 ' CH2' HD11 ' A' ' 106' ' ' LEU . 68.5 t-105 -58.79 -49.82 76.25 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 123.752 0.821 . . . . 0.0 110.047 178.777 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.583 ' HB2' ' O ' ' A' ' 94' ' ' THR . 5.9 t-20 -48.52 -44.33 36.05 Favored 'General case' 0 C--O 1.207 -1.174 0 C-N-CA 124.909 1.283 . . . . 0.0 110.11 179.096 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -66.84 -51.82 51.03 Favored 'General case' 0 N--CA 1.423 -1.797 0 CA-C-O 119.16 -0.447 . . . . 0.0 111.458 178.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.57 HD23 ' O ' ' A' ' 96' ' ' GLY . 0.4 OUTLIER -59.47 -34.51 72.64 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 121.396 0.617 . . . . 0.0 112.071 179.929 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.44 ' HA ' ' HA ' ' A' ' 105' ' ' THR . 24.0 t -78.0 -27.34 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.378 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.969 178.183 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 73.8 m -78.87 -32.08 45.79 Favored 'General case' 0 C--N 1.291 -1.969 0 O-C-N 121.08 -1.013 . . . . 0.0 109.022 176.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' TRP . . . . . . . . . . . . . 50.6 m0 -79.88 -49.78 11.43 Favored 'General case' 0 N--CA 1.423 -1.792 0 CA-C-N 115.428 -0.805 . . . . 0.0 112.316 -177.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -129.92 5.06 4.96 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -175.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.44 ' HA ' ' HA ' ' A' ' 101' ' ' VAL 0.321 13.6 t 49.63 -176.5 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 123.876 1.798 . . . . 0.0 115.268 -176.926 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.411 HD13 ' O ' ' A' ' 65' ' ' ILE . 37.0 tp -104.56 156.33 18.05 Favored 'General case' 1 C--N 1.23 -4.623 0 CA-C-N 112.022 -2.354 . . . . 0.0 107.251 -175.982 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 32.6 tpp -69.38 132.58 46.6 Favored 'General case' 1 N--CA 1.366 -4.633 0 CA-C-O 122.353 1.073 . . . . 0.0 110.294 178.559 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -63.92 136.87 57.72 Favored 'General case' 0 C--N 1.251 -3.677 0 CA-C-N 112.29 -2.232 . . . . 0.0 111.15 -176.093 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 93.64 -18.04 57.31 Favored Glycine 0 N--CA 1.416 -2.684 0 CA-C-N 114.99 -1.005 . . . . 0.0 112.533 179.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -113.88 127.33 55.94 Favored 'General case' 1 N--CA 1.362 -4.866 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 -179.581 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 -98.36 153.32 38.08 Favored Pre-proline 0 C--N 1.301 -1.536 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 -179.518 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_exo -48.49 129.36 19.66 Favored 'Trans proline' 0 CA--C 1.485 -1.953 0 C-N-CA 124.397 3.398 . . . . 0.0 115.985 -174.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.445 ' N ' HD13 ' A' ' 113' ' ' ILE . 3.1 mp -92.4 108.95 20.83 Favored 'Isoleucine or valine' 0 N--CA 1.384 -3.732 0 CA-C-N 111.796 -2.456 . . . . 0.0 105.764 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . 0.412 ' HB1' ' CG2' ' A' ' 29' ' ' THR . . . -118.6 149.89 40.6 Favored 'General case' 0 C--N 1.292 -1.901 0 N-CA-C 114.02 1.119 . . . . 0.0 114.02 -173.864 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 81.8 mtt180 -135.61 167.1 21.74 Favored 'General case' 0 CA--C 1.47 -2.113 0 C-N-CA 125.873 1.669 . . . . 0.0 107.121 172.181 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -101.33 176.02 5.38 Favored 'General case' 0 C--N 1.262 -3.234 0 C-N-CA 118.536 -1.266 . . . . 0.0 110.902 179.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.612 HG12 ' O ' ' A' ' 25' ' ' ARG . 48.3 t . . . . . 0 C--O 1.241 0.625 0 CA-C-O 122.687 1.232 . . . . 0.0 112.495 -176.166 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.434 ' HB2' ' CG2' ' A' ' 11' ' ' THR . . . . . . . . 0 CA--C 1.496 -1.112 0 CA-C-O 121.371 0.605 . . . . 0.0 111.34 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.644 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 13.3 t70 -64.19 143.06 58.17 Favored 'General case' 0 CA--C 1.48 -1.724 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.072 171.353 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -40.3 -56.83 1.88 Allowed 'General case' 0 C--N 1.299 -1.595 0 C-N-CA 126.422 1.889 . . . . 0.0 112.407 176.569 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -73.66 -25.66 60.37 Favored 'General case' 0 C--N 1.27 -2.879 0 CA-C-N 114.682 -1.144 . . . . 0.0 110.771 -174.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.519 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 2.2 m -68.31 -44.98 74.19 Favored 'General case' 0 N--CA 1.398 -3.064 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 175.553 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.644 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 75.1 mt-30 -55.41 -61.62 2.22 Favored 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 123.761 0.825 . . . . 0.0 112.484 -175.751 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.4 ptm180 -51.23 -41.56 60.4 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 121.373 0.606 . . . . 0.0 112.32 179.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.6 m -72.53 -44.25 62.43 Favored 'General case' 0 C--N 1.291 -1.954 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.792 -176.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.551 ' CG ' ' HZ2' ' A' ' 99' ' ' LYS . 23.2 t0 -76.04 -19.6 58.49 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.144 -174.406 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.572 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 27.4 mm -87.71 -31.07 5.71 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.159 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.024 176.242 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.522 ' O ' ' HG3' ' A' ' 21' ' ' LYS . . . -59.36 -35.09 73.24 Favored 'General case' 0 CA--C 1.498 -1.029 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 -177.828 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 7.3 m -53.8 -53.32 54.04 Favored 'General case' 0 N--CA 1.415 -2.181 0 C-N-CA 126.506 1.922 . . . . 0.0 111.048 176.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.557 ' HB3' ' HD2' ' A' ' 93' ' ' PRO . 1.6 mm? -72.1 -15.23 62.0 Favored 'General case' 1 N--CA 1.356 -5.141 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 179.951 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 11.9 mt -86.03 -24.1 26.53 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-O 121.929 0.871 . . . . 0.0 109.617 177.824 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.522 ' HG3' ' O ' ' A' ' 17' ' ' ALA . 0.1 OUTLIER -90.9 -4.12 56.79 Favored 'General case' 0 CA--C 1.5 -0.98 0 CA-C-O 122.33 1.062 . . . . 0.0 111.521 -174.25 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 32.0 m -90.07 141.44 28.67 Favored 'General case' 0 N--CA 1.389 -3.49 0 CA-C-N 113.557 -1.656 . . . . 0.0 111.048 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.1 m -108.62 166.26 10.93 Favored 'General case' 0 N--CA 1.399 -2.977 0 CA-C-N 113.734 -1.575 . . . . 0.0 110.743 178.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.537 ' H ' HD12 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -108.06 167.03 10.28 Favored 'General case' 1 N--CA 1.36 -4.936 0 CA-C-N 113.121 -1.854 . . . . 0.0 114.111 -170.897 . . . . . . . . 4 4 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.635 ' O ' HG23 ' A' ' 117' ' ' VAL . 0.0 OUTLIER -126.83 159.86 32.63 Favored 'General case' 0 C--N 1.261 -3.251 0 CA-C-N 111.423 -2.626 . . . . 0.0 104.873 -178.821 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -67.6 132.6 47.85 Favored 'General case' 0 C--N 1.289 -2.063 0 CA-C-N 117.939 0.336 . . . . 0.0 110.983 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 99.01 -2.7 58.21 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.864 -0.684 . . . . 0.0 113.559 176.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.559 ' OD2' ' HB2' ' A' ' 25' ' ' ARG . 8.3 m-20 -86.77 155.51 20.3 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 117.18 0.49 . . . . 0.0 112.179 -177.672 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.424 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 41.3 m -108.67 136.56 48.04 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.3 -178.692 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.508 ' CZ2' HD11 ' A' ' 24' ' ' LEU . 36.4 m95 -122.46 153.89 38.53 Favored 'General case' 0 N--CA 1.429 -1.515 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 176.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -106.56 129.35 54.52 Favored 'General case' 0 C--N 1.273 -2.729 0 CA-C-O 120.992 0.425 . . . . 0.0 110.246 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.727 HD12 ' CD1' ' A' ' 89' ' ' TYR . 27.1 tp -90.0 128.98 36.38 Favored 'General case' 1 N--CA 1.367 -4.625 0 CA-C-N 114.335 -1.302 . . . . 0.0 113.039 -177.229 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 55.3 t -118.09 139.77 44.02 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.012 0 C-N-CA 126.111 1.765 . . . . 0.0 108.743 -178.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.615 ' OD2' ' HB2' ' A' ' 36' ' ' ARG . 10.9 t70 -64.73 123.53 19.58 Favored 'General case' 0 C--N 1.299 -1.615 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 169.812 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.4 t -65.6 -27.55 68.49 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 120.989 0.423 . . . . 0.0 109.883 -172.564 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.615 ' HB2' ' OD2' ' A' ' 34' ' ' ASP . 67.8 mtt85 -66.95 -34.95 78.9 Favored 'General case' 0 C--O 1.243 0.752 0 C-N-CA 123.459 0.704 . . . . 0.0 110.236 -177.608 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 69.7 t90 -71.34 -46.25 60.99 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 175.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 30.3 t80 -58.6 -41.44 85.83 Favored 'General case' 0 CA--C 1.549 0.937 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.979 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.562 ' O ' ' HG3' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -51.32 -48.87 62.23 Favored 'General case' 0 CA--C 1.489 -1.395 0 CA-C-N 118.231 0.468 . . . . 0.0 111.178 173.075 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 22.4 tp60 -60.12 -43.92 95.29 Favored 'General case' 0 N--CA 1.409 -2.498 0 O-C-N 123.796 0.685 . . . . 0.0 110.634 -177.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 76.5 t90 -61.07 -39.99 91.97 Favored 'General case' 0 C--O 1.214 -0.77 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.451 178.526 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.48 ' HD3' ' HA ' ' A' ' 39' ' ' LYS . 14.4 mtpp -60.1 -41.0 91.57 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-O 120.927 0.394 . . . . 0.0 111.742 -178.494 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.562 ' HG3' ' O ' ' A' ' 39' ' ' LYS . 18.3 mtpp -73.57 -39.06 64.94 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 -175.316 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.507 ' O ' ' HA ' ' A' ' 55' ' ' MET . 0.2 OUTLIER -67.41 -44.34 79.03 Favored 'General case' 0 N--CA 1.428 -1.543 0 CA-C-N 114.173 -1.376 . . . . 0.0 111.205 -179.654 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.453 ' CG1' ' HB2' ' A' ' 47' ' ' PHE . 2.3 p -85.14 -12.34 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.608 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.323 -174.85 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 66.33 43.15 93.39 Favored Glycine 0 N--CA 1.44 -1.086 0 N-CA-C 109.879 -1.288 . . . . 0.0 109.879 -175.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.453 ' HB2' ' CG1' ' A' ' 45' ' ' VAL . 88.2 t80 -64.82 -40.51 95.32 Favored 'General case' 0 N--CA 1.437 -1.111 0 C-N-CA 123.802 0.841 . . . . 0.0 108.976 -179.039 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.473 ' O ' ' HB2' ' A' ' 52' ' ' LYS . 7.4 m-20 -95.64 132.74 40.48 Favored 'General case' 0 C--N 1.298 -1.639 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 179.253 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.2 m -69.11 -22.44 63.97 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-O 121.488 0.661 . . . . 0.0 111.982 -179.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 38.7 p90 -99.3 2.3 45.34 Favored 'General case' 0 C--N 1.302 -1.489 0 C-N-CA 123.512 0.725 . . . . 0.0 110.379 -177.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.495 ' OD2' ' HG2' ' A' ' 43' ' ' LYS . 14.9 t70 -150.18 73.15 1.14 Allowed 'General case' 0 CA--C 1.472 -2.03 0 N-CA-C 103.608 -2.738 . . . . 0.0 103.608 -176.634 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 48' ' ' ASP 0.386 53.4 tptt -142.57 13.89 1.95 Allowed 'General case' 0 N--CA 1.393 -3.3 0 CA-C-N 110.661 -2.972 . . . . 0.0 109.237 -157.733 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 59.7 m-85 -99.36 -13.28 19.67 Favored 'General case' 0 C--N 1.293 -1.88 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.435 -173.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.463 ' HB3' HG13 ' A' ' 60' ' ' VAL . 43.0 mt-30 -97.94 6.98 47.08 Favored 'General case' 0 N--CA 1.426 -1.644 0 N-CA-C 107.961 -1.125 . . . . 0.0 107.961 176.605 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' MET . . . . . 0.507 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 56.7 ttp -63.63 116.02 5.27 Favored 'General case' 0 N--CA 1.412 -2.352 0 CA-C-N 114.795 -1.093 . . . . 0.0 109.848 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.73 18.26 75.73 Favored Glycine 0 N--CA 1.429 -1.796 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.612 -179.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.523 ' HB3' HG23 ' A' ' 60' ' ' VAL . 9.3 t0 -94.34 143.95 25.96 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 179.313 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.452 ' O ' ' HD2' ' A' ' 61' ' ' TYR . 13.7 pt20 -84.3 -15.79 45.37 Favored 'General case' 0 C--N 1.291 -1.95 0 CA-C-O 122.007 0.908 . . . . 0.0 110.647 -179.198 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 -64.71 -28.06 69.34 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-N 114.659 -1.155 . . . . 0.0 111.217 177.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.523 HG23 ' HB3' ' A' ' 57' ' ' ASP . 33.2 m -115.65 1.82 8.12 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.099 0 CA-C-N 114.952 -1.022 . . . . 0.0 112.089 -172.038 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.452 ' HD2' ' O ' ' A' ' 58' ' ' GLN . 0.8 OUTLIER -64.87 118.13 45.68 Favored Pre-proline 0 C--N 1.307 -1.266 0 C-N-CA 119.638 -0.825 . . . . 0.0 109.696 -178.988 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 61' ' ' TYR . 18.4 Cg_endo -87.46 113.8 0.95 Allowed 'Trans proline' 0 N--CA 1.412 -3.282 0 C-N-CA 122.429 2.086 . . . . 0.0 109.828 177.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -73.26 -134.35 0.23 Allowed Glycine 0 C--N 1.275 -2.816 0 CA-C-N 114.233 -1.348 . . . . 0.0 112.105 177.115 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -56.65 131.06 43.31 Favored 'Trans proline' 0 CA--C 1.502 -1.108 0 C-N-CA 122.518 2.146 . . . . 0.0 112.357 -177.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.56 ' O ' HD22 ' A' ' 106' ' ' LEU . 96.2 mt -58.56 112.44 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.551 0 CA-C-N 114.365 -1.288 . . . . 0.0 109.505 177.185 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -106.86 103.45 12.89 Favored 'General case' 0 C--N 1.288 -2.095 0 N-CA-C 107.073 -1.455 . . . . 0.0 107.073 178.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.525 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 90.3 m-20 -90.74 6.22 45.0 Favored 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.818 173.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.8 m -54.13 -29.95 47.06 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.583 1.153 . . . . 0.0 111.971 -177.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -64.94 -25.16 70.58 Favored Glycine 0 CA--C 1.523 0.589 0 C-N-CA 121.59 -0.338 . . . . 0.0 112.295 178.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 72.8 mt -92.22 -23.03 19.48 Favored 'General case' 0 CA--C 1.496 -1.097 0 CA-C-O 120.816 0.341 . . . . 0.0 110.198 179.099 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 67' ' ' ASN . 21.5 mt -78.94 152.18 31.24 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.788 -172.418 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 72.9 mttt . . . . . 0 N--CA 1.422 -1.875 0 CA-C-O 122.981 1.372 . . . . 0.0 114.589 177.013 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.512 -0.486 0 CA-C-O 121.813 0.816 . . . . 0.0 110.1 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 15.2 mm-40 -119.69 7.24 11.02 Favored 'General case' 0 C--N 1.28 -2.431 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 -178.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 50.0 m -132.7 134.27 44.57 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 114.197 -1.365 . . . . 0.0 111.917 -173.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.9 mt -78.64 157.74 28.59 Favored 'General case' 0 C--N 1.315 -0.93 0 O-C-N 123.499 0.499 . . . . 0.0 109.731 175.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -72.89 158.47 35.44 Favored 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 173.054 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -90.06 -3.92 57.67 Favored 'General case' 0 C--N 1.293 -1.862 0 CA-C-O 121.075 0.464 . . . . 0.0 111.249 -178.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -99.25 11.37 39.25 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -177.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 32.6 mt -84.24 166.82 17.2 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-O 121.854 0.835 . . . . 0.0 113.162 -170.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.444 HG22 HD11 ' A' ' 87' ' ' LEU . 53.8 mt -142.23 173.61 7.21 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 N-CA-C 105.14 -2.17 . . . . 0.0 105.14 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.656 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 25.8 t70 -67.95 -142.03 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.95 0 CA-C-O 117.37 -1.3 . . . . 0.0 110.438 -179.524 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.482 ' HA ' ' O ' ' A' ' 89' ' ' TYR . 9.5 pt-20 -40.53 -18.62 0.01 OUTLIER 'General case' 0 N--CA 1.509 2.503 0 N-CA-C 117.625 2.454 . . . . 0.0 117.625 -173.09 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.444 HD11 HG22 ' A' ' 84' ' ' ILE . 21.0 mt -62.24 -51.57 67.23 Favored 'General case' 0 C--N 1.285 -2.232 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 171.049 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -102.12 -45.82 5.03 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.903 -177.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' TYR . . . . . 0.727 ' CD1' HD12 ' A' ' 32' ' ' LEU . 0.9 OUTLIER -140.3 167.89 21.08 Favored 'General case' 0 C--O 1.164 -3.416 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.669 -174.096 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 4.3 mt -136.16 146.69 28.77 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.511 0 O-C-N 120.851 -1.156 . . . . 0.0 110.665 178.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.522 ' CD2' HD11 ' A' ' 32' ' ' LEU . 64.5 mt -109.04 133.72 52.61 Favored 'General case' 0 C--N 1.291 -1.958 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.761 178.651 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.427 ' N ' HD13 ' A' ' 92' ' ' LEU . 1.0 OUTLIER -140.78 156.13 68.97 Favored Pre-proline 0 C--N 1.289 -2.038 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 -178.54 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.557 ' HD2' ' HB3' ' A' ' 19' ' ' LEU . 39.6 Cg_exo -64.58 168.9 12.19 Favored 'Trans proline' 0 C--O 1.252 1.215 0 C-N-CA 122.975 2.45 . . . . 0.0 111.225 175.789 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.413 HG23 ' ND2' ' A' ' 98' ' ' ASN . 86.9 m -45.62 -47.76 14.73 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 124.421 1.088 . . . . 0.0 109.766 172.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.466 ' O ' ' HG3' ' A' ' 99' ' ' LYS . 1.1 mp0 -51.8 -54.41 29.07 Favored 'General case' 0 C--O 1.209 -1.027 0 C-N-CA 125.421 1.488 . . . . 0.0 110.689 178.386 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.505 ' O ' HD23 ' A' ' 100' ' ' LEU . . . -54.98 -60.97 7.89 Favored Glycine 0 N--CA 1.43 -1.748 0 O-C-N 124.388 1.055 . . . . 0.0 111.273 -177.533 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 68.5 t-105 -52.13 -50.22 62.13 Favored 'General case' 0 C--N 1.308 -1.238 0 C-N-CA 124.361 1.064 . . . . 0.0 111.184 178.385 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.413 ' ND2' HG23 ' A' ' 94' ' ' THR . 89.6 m-20 -53.47 -37.21 62.45 Favored 'General case' 0 C--O 1.187 -2.208 0 CA-C-O 118.791 -0.623 . . . . 0.0 111.585 177.74 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.551 ' HZ2' ' CG ' ' A' ' 15' ' ' ASP . 87.6 mttt -69.56 -50.36 45.57 Favored 'General case' 0 N--CA 1.41 -2.449 0 CA-C-N 118.6 0.636 . . . . 0.0 109.827 -178.868 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.505 HD23 ' O ' ' A' ' 96' ' ' GLY . 0.8 OUTLIER -58.75 -38.49 78.55 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.295 0.569 . . . . 0.0 111.731 178.588 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.432 ' O ' ' HA ' ' A' ' 105' ' ' THR . 37.9 t -74.35 -31.16 27.8 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.931 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.428 178.816 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 57.9 m -72.17 -36.16 69.2 Favored 'General case' 0 N--CA 1.418 -2.071 0 CA-C-O 121.717 0.77 . . . . 0.0 109.512 -179.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' TRP . . . . . . . . . . . . . 38.4 m0 -78.57 -51.33 10.08 Favored 'General case' 0 N--CA 1.424 -1.738 0 CA-C-N 114.692 -1.14 . . . . 0.0 111.998 -176.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' TYR . . . . . 0.405 ' C ' ' HG1' ' A' ' 105' ' ' THR . 65.1 m-85 -123.2 4.39 9.21 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 114.558 1.318 . . . . 0.0 114.558 -172.427 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.432 ' HA ' ' O ' ' A' ' 101' ' ' VAL 0.271 22.8 p 54.29 174.87 0.02 OUTLIER 'General case' 0 N--CA 1.413 -2.301 0 N-CA-C 116.089 1.885 . . . . 0.0 116.089 -177.856 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.694 ' CD1' ' HD3' ' A' ' 112' ' ' PRO . 0.5 OUTLIER -98.86 179.88 4.5 Favored 'General case' 0 N--CA 1.407 -2.621 0 CA-C-N 114.961 -1.018 . . . . 0.0 108.308 -179.974 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' MET . . . . . 0.49 ' O ' ' HG2' ' A' ' 110' ' ' GLN . 19.5 ttm -94.95 134.58 37.46 Favored 'General case' 1 N--CA 1.347 -5.621 0 CA-C-O 122.027 0.918 . . . . 0.0 109.846 178.08 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -64.32 123.63 19.65 Favored 'General case' 0 N--CA 1.393 -3.319 0 CA-C-N 113.316 -1.766 . . . . 0.0 111.267 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 112.33 -19.01 22.73 Favored Glycine 0 N--CA 1.405 -3.371 0 C-N-CA 119.911 -1.138 . . . . 0.0 111.626 178.463 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . 0.49 ' HG2' ' O ' ' A' ' 107' ' ' MET . 2.6 pt20 -116.6 164.52 14.48 Favored 'General case' 0 N--CA 1.406 -2.628 0 C-N-CA 119.966 -0.694 . . . . 0.0 109.64 178.435 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -135.94 144.9 50.37 Favored Pre-proline 0 C--N 1.29 -1.985 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.15 -179.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . 0.694 ' HD3' ' CD1' ' A' ' 106' ' ' LEU . 36.3 Cg_exo -42.7 132.63 5.47 Favored 'Trans proline' 0 CA--C 1.457 -3.327 0 C-N-CA 125.216 3.944 . . . . 0.0 113.427 177.305 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.441 HD11 ' N ' ' A' ' 113' ' ' ILE . 3.2 mp -93.11 106.53 18.05 Favored 'Isoleucine or valine' 1 N--CA 1.368 -4.541 0 CA-C-N 113.302 -1.772 . . . . 0.0 106.527 177.73 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . 0.424 ' HB1' ' CG2' ' A' ' 29' ' ' THR . . . -91.08 127.7 36.61 Favored 'General case' 0 N--CA 1.406 -2.649 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 177.53 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 15.2 tpt180 -121.63 129.79 53.05 Favored 'General case' 0 C--N 1.271 -2.817 0 N-CA-C 105.732 -1.951 . . . . 0.0 105.732 -177.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? -82.28 168.34 17.7 Favored 'General case' 0 C--N 1.272 -2.793 0 C-N-CA 119.687 -0.805 . . . . 0.0 109.014 176.476 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.635 HG23 ' O ' ' A' ' 25' ' ' ARG . 65.4 t . . . . . 0 C--N 1.316 -0.871 0 CA-C-O 122.03 0.919 . . . . 0.0 111.157 -178.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.5 mtt . . . . . 0 CA--C 1.499 -0.987 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -94.55 -179.88 5.04 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 123.628 0.58 . . . . 0.0 109.674 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 55.8 mm-40 60.05 103.11 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.024 1.73 . . . . 0.0 114.064 176.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -62.85 -43.67 98.58 Favored Glycine 0 CA--C 1.508 -0.373 0 N-CA-C 110.959 -0.856 . . . . 0.0 110.959 176.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -101.66 151.9 18.64 Favored Glycine 0 N--CA 1.427 -1.935 0 N-CA-C 107.868 -2.093 . . . . 0.0 107.868 173.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 70.8 -168.93 0.16 Allowed 'General case' 0 C--O 1.242 0.686 0 C-N-CA 123.572 0.749 . . . . 0.0 111.083 -177.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.456 ' HB2' ' CG2' ' A' ' 11' ' ' THR . . . -102.73 158.98 15.88 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.877 -178.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.662 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 10.9 t70 -70.2 151.53 45.27 Favored 'General case' 0 CA--C 1.482 -1.658 0 N-CA-C 107.403 -1.332 . . . . 0.0 107.403 173.322 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 19.0 mt -60.25 -38.06 82.32 Favored 'General case' 0 C--N 1.305 -1.334 0 CA-C-O 121.083 0.468 . . . . 0.0 110.887 -175.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -62.14 -31.45 71.93 Favored 'General case' 0 N--CA 1.488 1.473 0 CA-C-N 114.463 -1.244 . . . . 0.0 108.485 -178.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.583 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 3.9 m -80.01 -49.77 11.34 Favored 'General case' 1 N--CA 1.371 -4.395 0 CA-C-N 113.427 -1.715 . . . . 0.0 110.682 178.291 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.662 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 60.0 mt-30 -51.61 -61.54 2.19 Favored 'General case' 0 C--N 1.347 0.487 0 C-N-CA 123.096 0.558 . . . . 0.0 112.085 -174.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.494 ' HA ' ' CH2' ' A' ' 41' ' ' TRP . 6.8 ppt_? -57.74 -38.84 76.04 Favored 'General case' 0 C--O 1.208 -1.109 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -179.255 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.3 t -77.75 -36.8 50.35 Favored 'General case' 0 C--N 1.282 -2.337 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.549 -175.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.452 ' O ' ' HG ' ' A' ' 19' ' ' LEU . 9.8 t70 -70.29 -41.39 73.42 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.464 0.65 . . . . 0.0 109.632 -177.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.517 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 44.7 mm -71.27 -31.89 45.4 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.906 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.306 178.28 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.99 -30.73 71.14 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.978 0.894 . . . . 0.0 108.695 177.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.443 ' HB ' ' O ' ' A' ' 15' ' ' ASP . 1.0 OUTLIER -71.59 -25.96 62.4 Favored 'General case' 0 N--CA 1.4 -2.96 0 CA-C-N 114.198 -1.365 . . . . 0.0 110.488 178.179 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.51 ' HB3' ' CG ' ' A' ' 93' ' ' PRO . 76.6 mt -85.2 -17.54 36.8 Favored 'General case' 0 C--N 1.282 -2.349 0 CA-C-O 121.038 0.447 . . . . 0.0 111.311 -177.268 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 12.3 mt -86.11 -26.71 25.1 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 -179.328 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.434 ' HE2' ' HA ' ' A' ' 18' ' ' THR . 0.0 OUTLIER -91.72 -5.34 53.83 Favored 'General case' 0 N--CA 1.432 -1.333 0 CA-C-N 114.458 -1.246 . . . . 0.0 110.344 177.692 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.403 ' HB ' ' HA ' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -76.43 138.82 40.58 Favored 'General case' 0 N--CA 1.415 -2.182 0 CA-C-N 113.2 -1.818 . . . . 0.0 110.868 178.727 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 71.2 m -57.56 142.96 42.77 Favored 'General case' 0 C--N 1.283 -2.318 0 CA-C-N 113.086 -1.87 . . . . 0.0 111.699 179.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.647 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP 0.296 0.5 OUTLIER -91.33 -27.07 18.62 Favored 'General case' 0 CA--C 1.465 -2.324 0 N-CA-C 116.743 2.127 . . . . 0.0 116.743 -175.315 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.454 ' O ' HG23 ' A' ' 117' ' ' VAL . 0.0 OUTLIER 63.67 112.01 0.03 OUTLIER 'General case' 0 C--N 1.249 -3.789 0 C-N-CA 127.782 2.433 . . . . 0.0 111.899 179.144 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -60.95 113.04 2.31 Favored 'General case' 0 C--N 1.292 -1.92 0 CA-C-O 121.233 0.539 . . . . 0.0 111.972 -177.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 103.16 7.57 43.3 Favored Glycine 0 N--CA 1.437 -1.29 0 CA-C-N 115.074 -0.966 . . . . 0.0 112.3 -177.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.41 ' HB2' ' HB2' ' A' ' 25' ' ' ARG . 4.8 t70 -87.39 -177.7 6.0 Favored 'General case' 0 C--O 1.248 1.013 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.459 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 40.3 m -126.74 118.06 23.95 Favored 'General case' 0 N--CA 1.424 -1.773 0 CA-C-O 121.427 0.632 . . . . 0.0 110.285 -176.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.647 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 18.2 m95 -107.01 164.72 11.9 Favored 'General case' 0 C--N 1.288 -2.084 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 178.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.428 ' O ' ' HA ' ' A' ' 91' ' ' LEU . 86.7 m-85 -122.43 137.51 54.84 Favored 'General case' 0 C--N 1.278 -2.501 0 N-CA-C 110.329 -0.249 . . . . 0.0 110.329 -178.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.429 ' CD1' ' HB2' ' A' ' 115' ' ' ARG . 9.5 mp -78.74 152.3 31.6 Favored 'General case' 0 C--N 1.309 -1.171 0 C-N-CA 120.275 -0.57 . . . . 0.0 111.626 178.586 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.496 HG11 ' O ' ' A' ' 34' ' ' ASP . 7.2 t -137.75 142.06 37.33 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.624 0 N-CA-C 105.691 -1.966 . . . . 0.0 105.691 172.208 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.496 ' O ' HG11 ' A' ' 33' ' ' VAL . 3.7 p-10 -71.05 141.12 50.9 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 173.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 33.5 p -69.48 -22.21 63.64 Favored 'General case' 0 C--N 1.285 -2.202 0 C-N-CA 120.404 -0.518 . . . . 0.0 111.814 -173.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 90.9 mtt180 -73.37 -40.58 64.25 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.005 -173.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.435 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 71.7 t90 -63.66 -48.05 78.79 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 108.28 -1.008 . . . . 0.0 108.28 178.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.527 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 32.6 t80 -63.29 -43.61 97.38 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-N 114.793 -1.094 . . . . 0.0 110.802 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.41 ' HA ' ' HE2' ' A' ' 42' ' ' LYS . 94.7 mttt -63.02 -34.12 76.88 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 176.698 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.435 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 17.7 tp60 -65.35 -43.87 89.51 Favored 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 172.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.494 ' CH2' ' HA ' ' A' ' 13' ' ' ARG . 65.6 t90 -58.94 -41.97 88.67 Favored 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 114.778 -1.101 . . . . 0.0 110.872 177.609 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.527 ' HG3' ' O ' ' A' ' 38' ' ' PHE . 40.4 mtmt -54.02 -41.89 68.51 Favored 'General case' 0 CA--C 1.507 -0.708 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 179.652 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -63.41 -49.31 74.28 Favored 'General case' 0 CA--C 1.504 -0.819 0 O-C-N 124.111 0.882 . . . . 0.0 109.89 178.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.433 ' HB2' HG21 ' A' ' 60' ' ' VAL . 0.1 OUTLIER -66.08 -41.4 90.73 Favored 'General case' 0 N--CA 1.427 -1.619 0 CA-C-N 114.257 -1.338 . . . . 0.0 112.003 -173.792 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.446 HG13 ' O ' ' A' ' 41' ' ' TRP . 5.7 p -90.36 -21.23 6.71 Favored 'Isoleucine or valine' 0 N--CA 1.395 -3.178 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.513 -174.269 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . 0.476 ' HA3' ' HG3' ' A' ' 52' ' ' LYS . . . 84.78 33.05 19.9 Favored Glycine 0 N--CA 1.418 -2.51 0 C-N-CA 120.32 -0.943 . . . . 0.0 111.162 -175.719 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -74.67 -41.3 60.54 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -88.25 121.36 30.56 Favored 'General case' 0 C--N 1.311 -1.077 0 N-CA-C 107.144 -1.428 . . . . 0.0 107.144 -178.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 31.6 m -60.13 -15.82 26.99 Favored 'General case' 0 C--N 1.297 -1.709 0 N-CA-C 117.323 2.342 . . . . 0.0 117.323 -168.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 63.6 p-90 -104.07 -9.47 18.75 Favored 'General case' 0 N--CA 1.379 -3.986 0 CA-C-N 120.484 1.493 . . . . 0.0 107.67 -177.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -122.13 73.5 1.1 Allowed 'General case' 0 N--CA 1.423 -1.78 0 CA-C-N 114.954 -1.021 . . . . 0.0 109.844 -165.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.476 ' HG3' ' HA3' ' A' ' 46' ' ' GLY . 0.0 OUTLIER -121.5 28.29 7.8 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.179 177.829 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -81.81 -26.34 34.43 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 175.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.474 ' HB3' HG13 ' A' ' 60' ' ' VAL . 11.2 mm100 -97.83 0.94 47.67 Favored 'General case' 0 N--CA 1.413 -2.298 0 CA-C-N 114.35 -1.295 . . . . 0.0 109.995 -178.151 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.3 tmm? -64.95 116.97 6.93 Favored 'General case' 0 N--CA 1.414 -2.252 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.608 -177.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 83.36 3.85 89.77 Favored Glycine 0 N--CA 1.431 -1.692 0 CA-C-N 114.468 -1.242 . . . . 0.0 111.692 -179.193 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.532 ' HB3' HG23 ' A' ' 60' ' ' VAL . 5.5 t0 -82.07 147.1 29.3 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 -176.408 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -84.33 -22.3 30.65 Favored 'General case' 0 C--N 1.296 -1.751 0 CA-C-O 121.347 0.594 . . . . 0.0 110.64 -178.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -60.8 -31.77 71.14 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 121.925 0.869 . . . . 0.0 110.783 -179.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.532 HG23 ' HB3' ' A' ' 57' ' ' ASP . 27.9 m -105.99 8.49 9.66 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.123 0 CA-C-N 114.457 -1.247 . . . . 0.0 111.881 -172.729 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.404 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 0.7 OUTLIER -60.12 119.04 38.51 Favored Pre-proline 0 C--N 1.304 -1.41 0 O-C-N 124.258 0.974 . . . . 0.0 109.349 179.326 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 61' ' ' TYR . 7.5 Cg_endo -88.07 112.9 0.77 Allowed 'Trans proline' 0 N--CA 1.415 -3.113 0 C-N-CA 122.385 2.057 . . . . 0.0 108.905 174.142 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -68.7 -139.47 0.08 OUTLIER Glycine 0 C--N 1.288 -2.138 0 CA-C-N 114.926 -1.034 . . . . 0.0 112.56 176.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.477 ' HA ' ' O ' ' A' ' 104' ' ' TYR . 28.7 Cg_exo -64.32 137.42 55.85 Favored 'Trans proline' 0 C--O 1.248 0.988 0 C-N-CA 122.075 1.85 . . . . 0.0 112.048 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 65.2 mt -60.01 124.15 13.82 Favored 'Isoleucine or valine' 0 C--O 1.242 0.685 0 C-N-CA 123.389 0.676 . . . . 0.0 110.345 -178.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -116.58 104.56 11.53 Favored 'General case' 0 CA--C 1.501 -0.934 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -172.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.606 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 45.6 m-80 -95.0 12.43 28.47 Favored 'General case' 0 C--N 1.295 -1.778 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.567 -176.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 49.6 m -56.55 -34.7 67.35 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -177.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -72.26 -16.15 77.04 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 121.506 -0.378 . . . . 0.0 112.404 178.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 48.0 mt -93.28 -31.52 14.67 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 178.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 67' ' ' ASN . 70.0 mt -76.45 146.02 38.87 Favored 'General case' 0 N--CA 1.433 -1.286 0 CA-C-N 114.65 -1.159 . . . . 0.0 110.646 -176.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 62.8 mttt -70.54 171.77 9.66 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 -177.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -75.35 101.28 4.69 Favored 'General case' 0 C--N 1.297 -1.676 0 CA-C-N 113.442 -1.708 . . . . 0.0 109.115 -179.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 114.04 -36.42 4.01 Favored Glycine 0 N--CA 1.432 -1.633 0 C-N-CA 120.218 -0.992 . . . . 0.0 113.243 177.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -118.74 131.0 56.12 Favored 'General case' 0 CA--C 1.49 -1.333 0 CA-C-N 117.16 0.48 . . . . 0.0 110.655 -177.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . 0.404 ' CA ' HD12 ' A' ' 71' ' ' LEU . . . -88.95 3.29 51.99 Favored 'General case' 0 C--N 1.3 -1.552 0 CA-C-O 121.925 0.869 . . . . 0.0 110.028 179.264 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 6.8 mm100 -117.04 5.58 12.83 Favored 'General case' 0 C--N 1.285 -2.203 0 CA-C-O 122.147 0.975 . . . . 0.0 108.791 -174.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 35.8 m -122.65 125.07 44.88 Favored 'General case' 0 C--N 1.281 -2.381 0 CA-C-N 114.007 -1.451 . . . . 0.0 109.75 -176.538 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.441 ' N ' HD23 ' A' ' 79' ' ' LEU . 2.4 mm? -85.02 151.1 24.42 Favored 'General case' 0 N--CA 1.428 -1.531 0 C-N-CA 123.361 0.664 . . . . 0.0 110.241 178.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.508 ' HB2' ' CD1' ' A' ' 83' ' ' LEU . 99.2 mttt -76.92 168.13 20.62 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-O 121.285 0.564 . . . . 0.0 111.377 176.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -74.25 -45.91 44.86 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 114.678 1.362 . . . . 0.0 114.678 -172.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 26.4 m-70 -81.3 -0.16 39.71 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -167.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.528 ' HB3' ' CE2' ' A' ' 89' ' ' TYR . 8.9 mp -57.3 133.02 54.76 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -179.56 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.471 HD11 HG22 ' A' ' 84' ' ' ILE . 49.5 mt -129.82 174.53 12.46 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.379 0 N-CA-C 104.926 -2.25 . . . . 0.0 104.926 177.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.497 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 62.4 t0 -57.12 -151.82 0.0 OUTLIER 'General case' 0 CA--C 1.594 2.657 0 C-N-CA 126.58 1.952 . . . . 0.0 110.412 179.167 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.717 ' HA ' ' O ' ' A' ' 89' ' ' TYR 0.322 0.0 OUTLIER -39.24 -17.81 0.01 OUTLIER 'General case' 1 N--CA 1.545 4.321 0 N-CA-C 117.884 2.55 . . . . 0.0 117.884 -172.558 . . . . . . . . 5 4 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.41 HD11 HG22 ' A' ' 84' ' ' ILE . 31.5 mt -60.8 -46.26 91.18 Favored 'General case' 0 C--N 1.278 -2.531 0 C-N-CA 124.683 1.193 . . . . 0.0 110.112 171.143 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -114.69 -45.8 2.98 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-O 121.407 0.623 . . . . 0.0 109.452 -178.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . 0.717 ' O ' ' HA ' ' A' ' 86' ' ' GLU . 2.0 p90 -138.27 -169.45 2.59 Favored 'General case' 1 C--O 1.139 -4.72 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 -176.114 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.431 HG23 ' N ' ' A' ' 91' ' ' LEU . 8.6 mt -149.05 162.85 4.68 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.903 0 N-CA-C 106.03 -1.841 . . . . 0.0 106.03 173.357 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.431 ' N ' HG23 ' A' ' 90' ' ' ILE . 2.5 mm? -120.12 147.41 44.91 Favored 'General case' 0 N--CA 1.404 -2.77 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 172.841 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -124.38 153.53 69.05 Favored Pre-proline 0 C--N 1.271 -2.811 0 CA-C-N 114.616 -1.175 . . . . 0.0 108.689 171.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.51 ' CG ' ' HB3' ' A' ' 19' ' ' LEU . 5.3 Cg_endo -63.24 168.18 11.44 Favored 'Trans proline' 0 N--CA 1.432 -2.107 0 N-CA-C 107.668 -1.705 . . . . 0.0 107.668 167.063 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 14.7 m -44.36 -48.14 9.72 Favored 'General case' 0 C--N 1.298 -1.652 0 O-C-N 123.743 0.652 . . . . 0.0 110.93 175.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -67.13 -38.92 86.41 Favored 'General case' 0 CA--C 1.472 -2.054 0 CA-C-N 115.052 -0.976 . . . . 0.0 112.086 -177.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.489 ' O ' ' HG ' ' A' ' 100' ' ' LEU . . . -63.86 -51.08 56.54 Favored Glycine 0 N--CA 1.405 -3.37 0 C-N-CA 120.575 -0.821 . . . . 0.0 111.129 -176.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 63.5 t-105 -59.7 -48.98 79.51 Favored 'General case' 0 C--N 1.292 -1.913 0 CA-C-N 114.198 -1.001 . . . . 0.0 110.273 175.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 -51.52 -38.49 54.36 Favored 'General case' 0 C--O 1.195 -1.79 0 O-C-N 123.389 0.43 . . . . 0.0 111.641 176.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 28.3 mttm -66.03 -50.4 64.33 Favored 'General case' 0 CA--C 1.47 -2.109 0 CA-C-O 121.239 0.542 . . . . 0.0 110.308 -179.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.489 ' HG ' ' O ' ' A' ' 96' ' ' GLY . 67.1 mt -67.61 -31.84 72.14 Favored 'General case' 0 C--N 1.275 -2.66 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.765 -176.116 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.446 ' HA ' ' HA ' ' A' ' 105' ' ' THR . 25.0 t -80.28 -24.83 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.398 -3.032 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.017 175.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 20.4 t -78.24 -35.05 48.8 Favored 'General case' 0 C--N 1.299 -1.626 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 178.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' TRP . . . . . 0.478 ' CZ3' ' HB3' ' A' ' 12' ' ' GLN . 34.7 m0 -82.99 -48.87 10.18 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.311 -177.395 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' TYR . . . . . 0.477 ' O ' ' HA ' ' A' ' 64' ' ' PRO . 60.9 m-85 -130.54 6.74 4.82 Favored 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 -173.159 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.446 ' HA ' ' HA ' ' A' ' 101' ' ' VAL 0.27 11.1 t 48.24 -173.27 0.01 OUTLIER 'General case' 0 C--O 1.236 0.389 0 CA-C-O 123.895 1.807 . . . . 0.0 115.13 -179.71 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -105.15 151.81 23.59 Favored 'General case' 1 C--N 1.236 -4.353 0 CA-C-N 112.213 -2.267 . . . . 0.0 105.724 -174.232 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 54.4 mmm -64.14 155.96 29.95 Favored 'General case' 0 CA--C 1.495 -1.146 0 CA-C-O 121.855 0.836 . . . . 0.0 111.627 175.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 20.1 pm0 -75.15 137.88 41.65 Favored 'General case' 0 N--CA 1.389 -3.5 0 CA-C-N 114.346 -1.297 . . . . 0.0 109.289 178.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 89.72 4.12 73.27 Favored Glycine 0 N--CA 1.422 -2.244 0 CA-C-N 114.999 -1.001 . . . . 0.0 112.267 179.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -120.48 169.17 10.58 Favored 'General case' 0 CA--C 1.482 -1.636 0 CA-C-O 121.689 0.756 . . . . 0.0 111.634 -178.45 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -137.76 158.87 70.83 Favored Pre-proline 0 N--CA 1.412 -2.325 0 CA-C-N 114.013 -1.449 . . . . 0.0 107.091 178.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_exo -67.14 134.49 34.15 Favored 'Trans proline' 0 CA--C 1.459 -3.253 0 C-N-CA 122.705 2.27 . . . . 0.0 111.255 175.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 3.7 mp -94.76 107.03 18.87 Favored 'Isoleucine or valine' 1 N--CA 1.377 -4.121 0 CA-C-N 113.654 -1.612 . . . . 0.0 106.97 176.646 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . 0.459 ' HB1' ' CG2' ' A' ' 29' ' ' THR . . . -94.02 128.4 40.36 Favored 'General case' 0 N--CA 1.41 -2.452 0 CA-C-O 121.94 0.876 . . . . 0.0 111.124 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.429 ' HB2' ' CD1' ' A' ' 32' ' ' LEU . 17.0 tpt180 -119.69 120.5 36.8 Favored 'General case' 0 C--N 1.28 -2.43 0 CA-C-N 113.909 -1.496 . . . . 0.0 108.085 -175.682 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -67.81 155.94 38.19 Favored 'General case' 0 N--CA 1.424 -1.741 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 172.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.454 HG23 ' O ' ' A' ' 25' ' ' ARG . 90.8 t -60.54 146.21 11.34 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.699 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 175.235 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . 0.439 ' HB ' ' HG2' ' A' ' 120' ' ' GLN . 5.2 m -67.13 150.28 11.17 Favored 'Isoleucine or valine' 0 N--CA 1.392 -3.333 0 CA-C-N 114.382 -1.281 . . . . 0.0 112.517 -175.377 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -95.3 -8.27 36.4 Favored 'General case' 0 C--N 1.285 -2.227 0 CA-C-N 113.838 -1.528 . . . . 0.0 110.392 -171.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.439 ' HG2' ' HB ' ' A' ' 118' ' ' VAL . 17.5 pt20 . . . . . 0 C--N 1.305 -1.33 0 CA-C-N 114.107 -1.406 . . . . 0.0 111.536 177.331 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 mpt? . . . . . 0 CA--C 1.5 -0.95 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -82.48 96.76 8.11 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 178.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -89.95 109.17 20.21 Favored 'General case' 0 C--N 1.296 -1.76 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.857 -177.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -155.41 10.49 0.36 Allowed Glycine 0 C--N 1.298 -1.57 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.416 177.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -84.76 86.16 1.56 Allowed Glycine 0 N--CA 1.441 -0.995 0 N-CA-C 111.394 -0.682 . . . . 0.0 111.394 -176.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.619 ' HA ' ' CD1' ' A' ' 103' ' ' TRP . . . -89.0 136.24 33.12 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-O 121.063 0.458 . . . . 0.0 112.15 -176.53 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.22 172.11 1.17 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.285 -1.325 . . . . 0.0 112.484 179.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.653 ' O ' ' HB ' ' A' ' 11' ' ' THR . 0.6 OUTLIER -62.43 140.07 58.57 Favored 'General case' 0 C--O 1.207 -1.138 0 CA-C-N 114.842 -1.072 . . . . 0.0 108.811 170.298 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.493 ' O ' ' HG3' ' A' ' 13' ' ' ARG . 16.9 mt -61.08 -42.32 98.28 Favored 'General case' 0 CA--C 1.489 -1.4 0 CA-C-O 121.68 0.752 . . . . 0.0 110.77 -174.354 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -64.99 -23.67 67.29 Favored 'General case' 0 C--N 1.292 -1.91 0 CA-C-N 114.424 -1.262 . . . . 0.0 109.464 -177.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.653 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 2.6 m -78.42 -51.65 9.73 Favored 'General case' 0 N--CA 1.389 -3.497 0 CA-C-N 114.722 -1.126 . . . . 0.0 109.761 174.153 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.632 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 52.0 mt-30 -51.58 -53.77 34.57 Favored 'General case' 0 C--N 1.353 0.733 0 C-N-CA 123.528 0.731 . . . . 0.0 111.492 -175.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.493 ' HG3' ' O ' ' A' ' 9' ' ' LEU . 45.1 mtm180 -45.06 -58.21 3.35 Favored 'General case' 0 N--CA 1.486 1.374 0 CA-C-O 121.942 0.877 . . . . 0.0 110.598 177.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 74.3 m -66.68 -45.96 77.19 Favored 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 113.735 -1.575 . . . . 0.0 112.769 -172.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.5 t0 -66.28 -39.57 89.49 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.977 -176.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.566 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 26.2 mm -76.07 -37.88 34.03 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.353 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.268 178.36 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.555 ' O ' ' HG2' ' A' ' 21' ' ' LYS . . . -57.79 -39.87 78.53 Favored 'General case' 0 CA--C 1.495 -1.156 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.419 ' HA ' ' HD3' ' A' ' 21' ' ' LYS . 5.7 m -60.22 -36.28 77.34 Favored 'General case' 0 N--CA 1.396 -3.143 0 CA-C-N 113.372 -1.74 . . . . 0.0 112.015 179.401 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.455 ' HB3' ' CG ' ' A' ' 93' ' ' PRO . 71.8 mt -85.65 -13.33 48.92 Favored 'General case' 0 C--N 1.269 -2.918 0 O-C-N 121.611 -0.68 . . . . 0.0 112.495 -176.755 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 16.2 mt -86.04 -25.25 26.02 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 177.101 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.555 ' HG2' ' O ' ' A' ' 17' ' ' ALA . 19.6 ptmt -91.42 -22.11 20.62 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.596 -176.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 16.4 m -51.06 134.95 25.98 Favored 'General case' 0 N--CA 1.402 -2.839 0 C-N-CA 125.204 1.402 . . . . 0.0 111.639 174.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 72.8 m -77.47 149.59 35.02 Favored 'General case' 0 N--CA 1.395 -3.2 0 CA-C-N 113.529 -1.669 . . . . 0.0 111.649 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -111.44 168.01 9.87 Favored 'General case' 0 N--CA 1.41 -2.44 0 CA-C-N 115.275 -0.875 . . . . 0.0 112.158 178.62 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.4 ' HD3' ' N ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -143.32 152.26 41.44 Favored 'General case' 0 C--N 1.281 -2.393 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 175.743 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -55.08 128.55 34.23 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 121.094 0.474 . . . . 0.0 110.858 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 113.3 -18.3 20.96 Favored Glycine 0 N--CA 1.424 -2.142 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.533 -177.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -72.28 141.15 48.9 Favored 'General case' 0 CA--C 1.498 -1.023 0 CA-C-N 117.288 0.544 . . . . 0.0 110.637 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 49.0 m -97.59 134.34 40.93 Favored 'General case' 0 C--N 1.294 -1.806 0 N-CA-C 107.448 -1.315 . . . . 0.0 107.448 175.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 39.3 m95 -120.12 137.04 54.38 Favored 'General case' 0 C--N 1.282 -2.364 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 67.6 m-85 -98.24 121.66 40.44 Favored 'General case' 0 C--N 1.264 -3.132 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.041 -176.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.767 HD13 ' CD1' ' A' ' 89' ' ' TYR . 15.9 tp -81.07 138.96 35.96 Favored 'General case' 0 N--CA 1.4 -2.933 0 CA-C-N 115.114 -0.948 . . . . 0.0 113.348 -178.588 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.484 HG11 ' O ' ' A' ' 34' ' ' ASP . 58.4 t -132.8 150.67 33.28 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.128 0 C-N-CA 126.126 1.77 . . . . 0.0 107.285 -177.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.497 ' OD2' ' HB2' ' A' ' 36' ' ' ARG . 6.8 t70 -72.16 136.86 46.61 Favored 'General case' 0 C--N 1.284 -2.264 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 169.553 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.418 ' OG ' ' HE3' ' A' ' 39' ' ' LYS . 29.1 t -68.8 -31.58 70.68 Favored 'General case' 0 C--N 1.3 -1.586 0 CA-C-O 121.028 0.442 . . . . 0.0 111.177 -174.804 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.497 ' HB2' ' OD2' ' A' ' 34' ' ' ASP . 55.7 mtt180 -69.66 -34.16 73.61 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.373 -175.073 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.485 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 76.5 t90 -67.5 -45.48 75.69 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 177.405 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -65.18 -39.69 93.24 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.112 -179.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.425 ' HA ' ' HD3' ' A' ' 42' ' ' LYS . 98.4 mttt -64.64 -33.68 76.52 Favored 'General case' 0 CA--C 1.506 -0.723 0 CA-C-O 120.898 0.38 . . . . 0.0 111.511 175.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.485 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 24.5 tp60 -64.42 -44.54 90.92 Favored 'General case' 0 N--CA 1.408 -2.571 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 175.6 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 65.1 t90 -60.76 -43.4 98.04 Favored 'General case' 0 C--O 1.217 -0.633 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.396 176.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.585 ' HG2' ' CD1' ' A' ' 47' ' ' PHE . 15.3 mtpp -57.35 -39.29 75.62 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 123.153 0.581 . . . . 0.0 112.109 -178.204 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 40.3 mttp -72.97 -40.29 65.43 Favored 'General case' 0 C--N 1.285 -2.211 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 177.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.501 ' HB2' HG21 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -68.76 -38.15 79.88 Favored 'General case' 0 C--N 1.289 -2.049 0 CA-C-N 114.861 -1.063 . . . . 0.0 110.142 -176.956 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.429 ' CG1' ' HB2' ' A' ' 47' ' ' PHE . 4.3 p -88.79 -17.84 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.626 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.499 -176.258 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.07 27.96 38.95 Favored Glycine 0 N--CA 1.438 -1.227 0 C-N-CA 120.418 -0.896 . . . . 0.0 112.138 -174.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.585 ' CD1' ' HG2' ' A' ' 42' ' ' LYS . 48.8 t80 -72.73 -38.3 67.46 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 176.171 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.44 ' HB2' ' O ' ' A' ' 51' ' ' ASP . 71.4 m-20 -73.82 111.2 8.74 Favored 'General case' 0 CA--C 1.491 -1.289 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 174.213 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 11.0 m -60.95 -37.23 81.66 Favored 'General case' 0 C--N 1.297 -1.677 0 CA-C-O 121.573 0.701 . . . . 0.0 109.694 178.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 49.2 p90 -81.74 -15.55 53.97 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 114.912 -1.04 . . . . 0.0 111.336 -179.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.44 ' O ' ' HB2' ' A' ' 48' ' ' ASP . 7.6 t70 -141.13 86.87 2.06 Favored 'General case' 0 CA--C 1.475 -1.932 0 CA-C-O 122.364 1.078 . . . . 0.0 110.82 -175.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 63.7 pttt -142.33 18.77 2.07 Favored 'General case' 0 C--N 1.28 -2.427 0 CA-C-N 113.95 -1.477 . . . . 0.0 110.225 -179.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -60.55 -28.43 68.43 Favored 'General case' 0 C--N 1.292 -1.894 0 CA-C-N 112.747 -2.024 . . . . 0.0 107.355 172.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -94.8 11.92 29.82 Favored 'General case' 0 N--CA 1.421 -1.898 0 CA-C-N 113.958 -1.474 . . . . 0.0 111.661 -174.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' MET . . . . . 0.485 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 43.8 ttm -59.46 113.04 1.99 Allowed 'General case' 0 N--CA 1.429 -1.503 0 CA-C-O 121.013 0.435 . . . . 0.0 111.059 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.38 4.78 90.04 Favored Glycine 0 N--CA 1.437 -1.296 0 CA-C-N 115.393 -0.821 . . . . 0.0 112.569 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.475 ' HB3' HG23 ' A' ' 60' ' ' VAL . 4.8 t70 -76.46 148.99 36.86 Favored 'General case' 0 CA--C 1.509 -0.596 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 -176.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -83.7 -14.59 51.34 Favored 'General case' 0 C--N 1.299 -1.592 0 CA-C-O 122.117 0.96 . . . . 0.0 109.618 -178.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 33.2 m-80 -65.34 -25.98 67.83 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.551 175.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.501 HG21 ' HB2' ' A' ' 44' ' ' TYR . 34.1 m -119.9 3.19 6.87 Favored 'Isoleucine or valine' 0 CA--C 1.476 -1.871 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -172.354 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.473 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 5.3 p90 -62.43 118.11 37.36 Favored Pre-proline 0 C--N 1.308 -1.228 0 C-N-CA 119.334 -0.946 . . . . 0.0 109.291 178.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.473 ' HD3' ' HA ' ' A' ' 61' ' ' TYR . 10.1 Cg_endo -88.63 111.04 0.6 Allowed 'Trans proline' 0 N--CA 1.418 -2.936 0 C-N-CA 122.397 2.065 . . . . 0.0 110.088 177.48 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -69.66 -153.9 0.88 Allowed Glycine 0 C--N 1.285 -2.286 0 CA-C-N 115.081 -0.963 . . . . 0.0 112.066 175.249 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.495 ' HB2' ' SD ' ' A' ' 107' ' ' MET . 88.6 Cg_exo -51.38 137.61 47.48 Favored 'Trans proline' 0 C--O 1.252 1.183 0 C-N-CA 122.929 2.419 . . . . 0.0 113.031 -179.721 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.41 HG12 ' CZ2' ' A' ' 37' ' ' TRP . 45.9 mt -64.18 110.51 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.012 0 CA-C-N 114.498 -1.228 . . . . 0.0 111.196 -175.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.452 ' HB2' ' HG3' ' A' ' 107' ' ' MET . 17.5 t70 -104.4 115.64 30.73 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.182 177.371 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -111.53 24.07 13.21 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.778 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 30.2 m -70.59 9.03 0.7 Allowed 'General case' 0 CA--C 1.554 1.133 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 -177.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -109.89 -4.97 29.47 Favored Glycine 0 CA--C 1.496 -1.105 0 C-N-CA 119.14 -1.505 . . . . 0.0 109.782 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.586 ' CD1' ' HB3' ' A' ' 89' ' ' TYR . 2.2 mm? -98.46 -52.99 3.46 Favored 'General case' 0 N--CA 1.418 -2.026 0 CA-C-N 113.482 -1.359 . . . . 0.0 109.797 -176.679 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.497 ' HA ' ' HA ' ' A' ' 79' ' ' LEU . 78.7 mt -59.86 147.13 39.5 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.224 -1.353 . . . . 0.0 113.842 -175.521 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.9 mtpt -83.52 -170.75 3.21 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-N 113.98 -1.463 . . . . 0.0 108.968 176.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -88.41 132.29 34.51 Favored 'General case' 0 C--N 1.286 -2.168 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.969 -172.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 82.27 -55.46 4.95 Favored Glycine 0 C--N 1.316 -0.567 0 N-CA-C 115.206 0.842 . . . . 0.0 115.206 173.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -57.46 -49.67 75.52 Favored 'General case' 0 CA--C 1.474 -1.977 0 CA-C-O 122.199 0.999 . . . . 0.0 112.889 -174.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . 58.22 13.59 2.4 Favored 'General case' 0 C--N 1.257 -3.431 0 CA-C-N 112.303 -2.226 . . . . 0.0 113.117 -176.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.472 HE22 ' HB2' ' A' ' 111' ' ' GLU . 23.5 mm-40 -125.03 5.46 7.94 Favored 'General case' 0 CA--C 1.478 -1.8 0 N-CA-C 106.601 -1.629 . . . . 0.0 106.601 177.603 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.7 m -131.54 122.16 25.66 Favored 'General case' 0 C--N 1.28 -2.446 0 CA-C-N 112.594 -2.094 . . . . 0.0 109.061 -172.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.549 ' HG ' ' CD2' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -103.64 163.31 12.4 Favored 'General case' 0 N--CA 1.423 -1.814 0 O-C-N 123.451 0.469 . . . . 0.0 109.931 176.023 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.491 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 49.2 mtmt -60.59 116.5 4.4 Favored 'General case' 0 C--N 1.293 -1.85 0 CA-C-O 122.116 0.96 . . . . 0.0 111.802 -177.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -64.39 -8.99 15.22 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 115.027 1.492 . . . . 0.0 115.027 -172.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 46.0 m-70 -98.22 0.29 45.51 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 122.135 -0.353 . . . . 0.0 111.491 178.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 80' ' ' LYS . 56.6 mt -77.09 133.28 39.08 Favored 'General case' 0 C--O 1.248 1.026 0 CA-C-O 121.178 0.513 . . . . 0.0 109.808 179.719 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 49.2 mt -89.0 171.3 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.615 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 178.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.682 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 19.3 t70 -59.64 -139.52 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.971 0 C-N-CA 125.953 1.701 . . . . 0.0 111.041 -179.312 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.595 ' HA ' ' O ' ' A' ' 89' ' ' TYR . 0.1 OUTLIER -41.44 -18.82 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.565 0 N-CA-C 117.231 2.308 . . . . 0.0 117.231 -174.204 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.416 HD22 ' OE2' ' A' ' 86' ' ' GLU . 35.8 mt -60.96 -50.78 72.02 Favored 'General case' 0 C--N 1.292 -1.934 0 CA-C-O 121.57 0.7 . . . . 0.0 109.702 171.588 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -105.51 -45.79 4.35 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.794 -179.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . 0.767 ' CD1' HD13 ' A' ' 32' ' ' LEU . 1.5 p90 -139.09 -176.79 4.63 Favored 'General case' 0 C--O 1.161 -3.564 0 CA-C-O 119.323 -0.37 . . . . 0.0 110.703 -175.544 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.415 HG21 ' N ' ' A' ' 91' ' ' LEU . 5.4 mt -143.48 151.53 16.8 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.472 0 CA-C-N 119.493 1.042 . . . . 0.0 109.329 176.334 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.474 HD21 ' HA ' ' A' ' 32' ' ' LEU . 64.2 mt -112.67 133.82 54.5 Favored 'General case' 0 N--CA 1.4 -2.961 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.268 175.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 56.0 mt -121.09 150.77 54.24 Favored Pre-proline 0 C--N 1.281 -2.404 0 CA-C-N 113.744 -1.571 . . . . 0.0 107.366 -178.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.455 ' CG ' ' HB3' ' A' ' 19' ' ' LEU . 72.2 Cg_endo -76.21 169.12 22.66 Favored 'Trans proline' 0 N--CA 1.429 -2.27 0 N-CA-C 107.902 -1.615 . . . . 0.0 107.902 172.508 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 58.1 m -38.25 -54.71 1.39 Allowed 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 123.999 0.92 . . . . 0.0 112.988 177.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -71.56 -32.44 68.11 Favored 'General case' 0 CA--C 1.498 -1.025 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -175.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.417 ' O ' ' HG ' ' A' ' 100' ' ' LEU . . . -59.03 -47.69 89.57 Favored Glycine 0 N--CA 1.436 -1.353 0 N-CA-C 109.99 -1.244 . . . . 0.0 109.99 177.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 69.1 t-105 -67.8 -50.05 58.98 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 123.512 0.725 . . . . 0.0 110.114 178.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -53.3 -31.29 43.26 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 179.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 39.7 mttm -68.39 -55.43 12.0 Favored 'General case' 0 CA--C 1.468 -2.206 0 C-N-CA 123.172 0.589 . . . . 0.0 110.309 176.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.463 HD22 ' CE3' ' A' ' 103' ' ' TRP . 80.9 mt -64.32 -32.83 74.59 Favored 'General case' 0 C--N 1.275 -2.635 0 CA-C-N 114.885 -1.052 . . . . 0.0 112.196 -176.076 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 10.3 t -78.02 -25.87 14.41 Favored 'Isoleucine or valine' 0 N--CA 1.401 -2.89 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.247 175.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 14.7 t -81.38 -33.87 32.03 Favored 'General case' 0 C--N 1.295 -1.787 0 O-C-N 121.425 -0.797 . . . . 0.0 109.086 178.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' TRP . . . . . 0.619 ' CD1' ' HA ' ' A' ' 6' ' ' ALA . 50.3 m0 -79.93 -45.04 19.25 Favored 'General case' 0 N--CA 1.429 -1.489 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.426 -178.118 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 33.5 m-85 -128.99 -4.05 5.09 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 115.241 1.571 . . . . 0.0 115.241 -174.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . 0.279 7.9 p 58.3 167.28 0.05 OUTLIER 'General case' 0 N--CA 1.42 -1.931 0 N-CA-C 116.211 1.93 . . . . 0.0 116.211 -174.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 30.2 tp -92.4 157.24 16.7 Favored 'General case' 0 C--N 1.281 -2.411 0 CA-C-N 114.09 -1.414 . . . . 0.0 107.438 176.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.495 ' SD ' ' HB2' ' A' ' 64' ' ' PRO . 62.8 mmm -74.17 156.37 37.39 Favored 'General case' 0 CA--C 1.49 -1.352 0 CA-C-O 121.775 0.798 . . . . 0.0 110.428 174.553 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -89.32 153.56 20.78 Favored 'General case' 0 N--CA 1.394 -3.242 0 CA-C-N 114.32 -1.309 . . . . 0.0 109.2 -179.037 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 101.41 -29.97 11.39 Favored Glycine 0 N--CA 1.415 -2.719 0 C-N-CA 119.873 -1.156 . . . . 0.0 110.965 -176.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -117.14 177.09 4.84 Favored 'General case' 0 N--CA 1.421 -1.904 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . 0.472 ' HB2' HE22 ' A' ' 77' ' ' GLN . 49.1 mt-10 -135.09 160.31 68.77 Favored Pre-proline 0 C--N 1.298 -1.661 0 N-CA-C 106.925 -1.509 . . . . 0.0 106.925 -178.36 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -55.99 122.66 12.16 Favored 'Trans proline' 0 CA--C 1.459 -3.256 0 C-N-CA 122.723 2.282 . . . . 0.0 111.054 177.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 33.8 mt -79.63 105.93 9.9 Favored 'Isoleucine or valine' 1 N--CA 1.379 -4.002 0 CA-C-N 113.05 -1.887 . . . . 0.0 106.957 -179.375 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -98.22 129.97 44.95 Favored 'General case' 0 C--N 1.266 -3.065 0 CA-C-O 121.913 0.863 . . . . 0.0 110.767 -178.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.509 ' HA ' ' NE ' ' A' ' 115' ' ' ARG . 4.0 mmp_? -124.33 -174.47 3.02 Favored 'General case' 0 N--CA 1.395 -3.209 0 N-CA-C 105.111 -2.181 . . . . 0.0 105.111 176.552 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 61.3 pttt -153.01 173.85 14.9 Favored 'General case' 0 C--N 1.254 -3.566 0 C-N-CA 119.822 -0.751 . . . . 0.0 109.658 -177.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 21.4 t -66.54 138.26 23.3 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.791 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 172.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 27.9 m -84.71 175.72 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.267 -2.998 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.627 -174.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -98.88 6.45 46.79 Favored 'General case' 0 C--N 1.294 -1.813 0 CA-C-N 115.01 -0.995 . . . . 0.0 111.178 -179.155 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 . . . . . 0 C--N 1.304 -1.374 0 CA-C-N 113.794 -1.548 . . . . 0.0 107.618 176.813 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.421 ' SD ' ' N ' ' A' ' 2' ' ' ALA . 0.0 OUTLIER . . . . . 0 CA--C 1.515 -0.392 0 N-CA-C 105.044 -2.206 . . . . 0.0 105.044 . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.421 ' N ' ' SD ' ' A' ' 1' ' ' MET . . . 66.92 36.71 4.23 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-O 122.248 1.023 . . . . 0.0 108.666 -175.324 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -63.1 147.34 51.06 Favored 'General case' 0 C--O 1.252 1.188 0 CA-C-N 113.333 -1.758 . . . . 0.0 110.089 -178.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -88.58 -68.91 1.27 Allowed Glycine 0 N--CA 1.435 -1.422 0 N-CA-C 111.32 -0.712 . . . . 0.0 111.32 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -167.8 109.06 0.32 Allowed Glycine 0 N--CA 1.437 -1.298 0 N-CA-C 111.232 -0.747 . . . . 0.0 111.232 178.182 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -137.71 165.45 26.38 Favored 'General case' 0 C--N 1.301 -1.504 0 CA-C-N 116.889 0.345 . . . . 0.0 110.58 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.428 ' HB2' ' CG2' ' A' ' 11' ' ' THR . . . -79.22 172.9 13.16 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.525 -179.591 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.654 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 15.0 t70 -67.4 145.47 55.02 Favored 'General case' 0 CA--C 1.483 -1.605 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 175.199 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 38.1 mt -55.07 -41.79 71.96 Favored 'General case' 0 CA--C 1.494 -1.18 0 CA-C-N 119.03 0.832 . . . . 0.0 110.234 -177.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -69.0 -35.9 77.22 Favored 'General case' 0 CA--C 1.494 -1.206 0 CA-C-N 114.461 -1.245 . . . . 0.0 109.989 -177.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.506 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 5.4 m -65.2 -52.37 55.15 Favored 'General case' 0 N--CA 1.389 -3.522 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.028 177.042 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.654 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 79.1 mt-30 -49.31 -54.07 18.84 Favored 'General case' 0 CA--C 1.504 -0.806 0 C-N-CA 124.444 1.097 . . . . 0.0 111.934 -177.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.7 ptt180 -64.01 -43.46 95.55 Favored 'General case' 0 N--CA 1.434 -1.256 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.646 -174.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 44.7 m -69.27 -44.52 71.71 Favored 'General case' 0 C--N 1.288 -2.07 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.244 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -63.81 -37.54 87.75 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.023 0.929 . . . . 0.0 109.962 -175.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.503 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 34.7 mm -78.97 -37.45 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.164 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.299 177.8 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.72 -36.71 77.11 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 -178.146 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 1.3 m -62.48 -32.95 73.93 Favored 'General case' 0 N--CA 1.412 -2.353 0 C-N-CA 124.786 1.234 . . . . 0.0 111.757 177.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 69.0 mt -85.86 -14.01 46.24 Favored 'General case' 0 C--N 1.278 -2.53 0 O-C-N 121.251 -0.906 . . . . 0.0 111.7 -177.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 14.3 mt -84.67 -26.13 27.99 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 177.113 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.39 -13.95 31.51 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-O 122.275 1.036 . . . . 0.0 111.348 -176.859 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 5.6 m -72.33 145.06 48.05 Favored 'General case' 0 N--CA 1.402 -2.869 0 CA-C-N 113.67 -1.604 . . . . 0.0 109.386 173.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.7 t -100.58 161.68 13.44 Favored 'General case' 0 N--CA 1.401 -2.891 0 CA-C-O 121.7 0.762 . . . . 0.0 110.628 -176.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.65 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP . 0.5 OUTLIER -99.46 167.68 10.46 Favored 'General case' 0 C--N 1.294 -1.826 0 CA-C-N 114.57 -1.196 . . . . 0.0 112.829 179.782 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -104.88 -157.45 0.61 Allowed 'General case' 0 C--N 1.291 -1.948 0 N-CA-C 105.939 -1.874 . . . . 0.0 105.939 176.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.505 ' C ' HG22 ' A' ' 117' ' ' VAL . 16.1 ptpt -119.39 29.98 7.35 Favored 'General case' 0 N--CA 1.414 -2.259 0 CA-C-O 121.478 0.656 . . . . 0.0 110.352 172.095 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.472 ' N ' HG22 ' A' ' 117' ' ' VAL . . . -149.78 20.34 1.14 Allowed Glycine 0 CA--C 1.54 1.618 0 CA-C-N 114.831 -1.077 . . . . 0.0 114.165 176.223 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -96.15 -174.48 3.1 Favored 'General case' 0 N--CA 1.491 1.588 0 CA-C-N 118.544 1.172 . . . . 0.0 110.055 -178.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.407 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 90.1 m -133.71 127.44 32.84 Favored 'General case' 0 N--CA 1.425 -1.698 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 170.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.65 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 17.1 m95 -114.33 163.72 14.9 Favored 'General case' 0 C--N 1.277 -2.584 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -123.46 141.87 51.57 Favored 'General case' 0 C--N 1.278 -2.505 0 C-N-CA 121.069 -0.252 . . . . 0.0 111.507 -175.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.579 ' HA ' ' O ' ' A' ' 90' ' ' ILE . 5.5 mp -92.04 134.64 34.63 Favored 'General case' 0 CA--C 1.461 -2.452 0 O-C-N 124.54 1.15 . . . . 0.0 111.512 -179.71 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.428 HG13 ' O ' ' A' ' 34' ' ' ASP . 95.8 t -116.52 142.65 29.21 Favored 'Isoleucine or valine' 0 C--N 1.251 -3.69 0 N-CA-C 102.932 -2.988 . . . . 0.0 102.932 171.853 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.428 ' O ' HG13 ' A' ' 33' ' ' VAL . 10.2 p-10 -72.75 136.7 45.55 Favored 'General case' 0 C--N 1.278 -2.541 0 N-CA-C 106.897 -1.52 . . . . 0.0 106.897 174.004 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 61.9 p -62.3 -28.36 69.68 Favored 'General case' 0 C--N 1.272 -2.802 0 CA-C-N 114.278 -1.328 . . . . 0.0 110.024 -173.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.9 mmt85 -69.96 -45.78 66.67 Favored 'General case' 0 N--CA 1.423 -1.824 0 CA-C-N 114.02 -1.446 . . . . 0.0 110.058 -173.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.514 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 69.1 t90 -67.61 -44.19 78.65 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 179.36 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 38.4 t80 -61.86 -37.83 85.99 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.185 -178.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -73.78 -23.66 59.73 Favored 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 121.693 -0.629 . . . . 0.0 112.627 178.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.514 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 24.5 tp60 -70.29 -42.61 71.84 Favored 'General case' 0 N--CA 1.412 -2.341 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 172.114 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.431 ' O ' HG21 ' A' ' 45' ' ' VAL . 78.4 t90 -62.31 -39.39 92.88 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-N 114.241 -1.345 . . . . 0.0 110.529 176.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.522 ' HG2' ' CD2' ' A' ' 47' ' ' PHE . 11.5 mtpp -55.57 -46.77 77.16 Favored 'General case' 0 CA--C 1.498 -1.032 0 C-N-CA 123.265 0.626 . . . . 0.0 111.683 178.475 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -57.66 -52.5 65.19 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 124.766 1.291 . . . . 0.0 110.727 178.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.507 ' HB2' HG21 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -60.61 -36.42 78.56 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 113.594 -1.639 . . . . 0.0 114.226 -175.241 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.431 HG21 ' O ' ' A' ' 41' ' ' TRP . 18.8 m -95.95 -17.26 6.99 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.781 0 N-CA-C 113.234 0.827 . . . . 0.0 113.234 -178.842 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . 0.516 ' HA3' ' CB ' ' A' ' 52' ' ' LYS . . . 79.79 38.12 20.92 Favored Glycine 0 N--CA 1.4 -3.743 0 C-N-CA 119.949 -1.12 . . . . 0.0 110.967 -172.698 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.522 ' CD2' ' HG2' ' A' ' 42' ' ' LYS . 75.9 t80 -63.22 -40.43 97.44 Favored 'General case' 0 N--CA 1.442 -0.827 0 C-N-CA 123.022 0.529 . . . . 0.0 111.562 -176.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.495 ' HB3' ' HB3' ' A' ' 51' ' ' ASP . 3.5 t70 -92.3 -178.95 5.09 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 -174.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' SER . . . . . 0.462 ' O ' ' HE2' ' A' ' 52' ' ' LYS . 20.8 m -84.94 -37.17 20.85 Favored 'General case' 0 C--N 1.294 -1.822 0 N-CA-C 111.755 0.279 . . . . 0.0 111.755 -176.696 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 66.7 p-90 -105.13 -21.14 13.32 Favored 'General case' 0 N--CA 1.39 -3.471 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 -178.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.495 ' HB3' ' HB3' ' A' ' 48' ' ' ASP . 31.7 t0 -94.98 73.29 3.46 Favored 'General case' 0 CA--C 1.461 -2.449 0 CA-C-N 114.071 -1.422 . . . . 0.0 108.776 -170.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.516 ' CB ' ' HA3' ' A' ' 46' ' ' GLY . 65.2 pttt -162.39 9.68 0.06 Allowed 'General case' 0 N--CA 1.415 -2.192 0 CA-C-N 112.689 -2.051 . . . . 0.0 114.058 -174.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -63.53 -22.9 67.15 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-O 122.639 1.209 . . . . 0.0 108.101 171.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.462 ' HB3' HG13 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -94.48 11.34 31.13 Favored 'General case' 0 N--CA 1.427 -1.594 0 CA-C-N 113.426 -1.715 . . . . 0.0 110.858 -175.817 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 46.5 ttm -62.11 115.13 3.85 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 110.067 -0.345 . . . . 0.0 110.067 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.03 20.55 77.5 Favored Glycine 0 N--CA 1.44 -1.094 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.824 -179.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.507 ' HB3' HG23 ' A' ' 60' ' ' VAL . 5.7 t0 -91.83 147.6 22.86 Favored 'General case' 0 CA--C 1.503 -0.846 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 -179.302 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.445 ' O ' ' HD2' ' A' ' 61' ' ' TYR . 19.4 pt20 -83.21 -17.56 42.35 Favored 'General case' 0 C--N 1.296 -1.72 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 -62.39 -25.26 67.83 Favored 'General case' 0 CA--C 1.492 -1.27 0 CA-C-N 115.043 -0.981 . . . . 0.0 111.41 177.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.507 HG21 ' HB2' ' A' ' 44' ' ' TYR . 26.5 m -121.19 7.44 6.07 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.824 0 CA-C-N 115.028 -0.987 . . . . 0.0 112.099 -172.401 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.445 ' HD2' ' O ' ' A' ' 58' ' ' GLN . 0.9 OUTLIER -62.73 116.53 24.41 Favored Pre-proline 0 C--N 1.305 -1.342 0 O-C-N 124.052 0.845 . . . . 0.0 111.067 -178.419 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 61' ' ' TYR . 15.0 Cg_endo -89.78 117.97 0.75 Allowed 'Trans proline' 0 N--CA 1.41 -3.399 0 C-N-CA 122.699 2.266 . . . . 0.0 111.422 177.555 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -73.45 -153.67 2.64 Favored Glycine 0 C--N 1.273 -2.95 0 CA-C-N 113.806 -1.543 . . . . 0.0 111.253 171.046 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.83 143.06 82.76 Favored 'Trans proline' 0 C--O 1.245 0.859 0 C-N-CA 122.82 2.347 . . . . 0.0 112.662 -178.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 42.2 mt -64.95 114.07 2.3 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.115 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.82 -176.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.459 ' HB2' ' HG3' ' A' ' 107' ' ' MET . 24.4 t70 -113.35 104.96 12.83 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 116.022 -0.535 . . . . 0.0 109.769 178.687 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -91.22 19.51 5.84 Favored 'General case' 0 C--N 1.303 -1.419 0 CA-C-N 116.925 -0.125 . . . . 0.0 111.245 -176.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 33.2 t -54.75 -31.66 58.8 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -176.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -66.06 -18.25 66.62 Favored Glycine 0 CA--C 1.527 0.79 0 C-N-CA 121.296 -0.478 . . . . 0.0 113.446 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 32.1 mt -93.61 -21.61 19.3 Favored 'General case' 0 C--O 1.247 0.928 0 CA-C-O 121.395 0.617 . . . . 0.0 109.388 179.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.478 HD12 ' HA ' ' A' ' 76' ' ' ALA . 50.3 mt -79.87 137.6 36.97 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.713 -173.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -78.43 -174.62 3.87 Favored 'General case' 0 C--O 1.246 0.891 0 CA-C-O 122.264 1.031 . . . . 0.0 111.135 178.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -95.25 93.79 7.5 Favored 'General case' 0 N--CA 1.423 -1.825 0 N-CA-C 106.142 -1.799 . . . . 0.0 106.142 172.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 179.27 -64.95 0.08 OUTLIER Glycine 0 N--CA 1.425 -2.075 0 N-CA-C 110.012 -1.235 . . . . 0.0 110.012 -177.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -148.37 170.59 17.62 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 177.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . 0.478 ' HA ' HD12 ' A' ' 71' ' ' LEU . . . -83.66 2.04 39.5 Favored 'General case' 0 C--N 1.3 -1.572 0 CA-C-O 121.939 0.876 . . . . 0.0 109.629 177.681 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 23.2 mm-40 -114.94 3.13 14.45 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.238 178.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 94.7 p -98.13 113.04 24.81 Favored 'General case' 0 C--N 1.297 -1.683 0 CA-C-N 115.164 -0.926 . . . . 0.0 111.343 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -93.68 141.87 28.0 Favored 'General case' 0 N--CA 1.425 -1.705 0 C-N-CA 123.867 0.867 . . . . 0.0 111.459 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -61.69 139.27 58.32 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.318 0.58 . . . . 0.0 111.163 175.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.48 ' CD ' ' H ' ' A' ' 81' ' ' GLU . 0.4 OUTLIER -58.56 -48.07 82.11 Favored 'General case' 0 C--N 1.301 -1.501 0 C-N-CA 124.838 1.255 . . . . 0.0 110.139 -176.445 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 71.9 m80 -84.85 12.06 8.11 Favored 'General case' 0 C--N 1.295 -1.793 0 CA-C-N 113.971 -1.468 . . . . 0.0 114.053 -170.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 74.9 mt -60.49 119.59 8.32 Favored 'General case' 0 C--O 1.24 0.604 0 CA-C-O 120.879 0.371 . . . . 0.0 111.965 178.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.516 ' O ' ' HB2' ' A' ' 88' ' ' ASP . 51.2 mt -98.89 171.78 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.434 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 173.514 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.6 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 24.0 t70 -62.87 -139.08 0.0 OUTLIER 'General case' 0 C--O 1.185 -2.292 0 C-N-CA 125.183 1.393 . . . . 0.0 111.497 -177.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.675 ' HA ' ' O ' ' A' ' 89' ' ' TYR 0.271 1.0 OUTLIER -40.72 -20.54 0.01 OUTLIER 'General case' 0 N--CA 1.535 3.799 0 N-CA-C 117.018 2.229 . . . . 0.0 117.018 -173.192 . . . . . . . . 4 4 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.509 HD11 ' CG2' ' A' ' 84' ' ' ILE . 66.1 mt -60.81 -57.98 10.37 Favored 'General case' 0 C--N 1.281 -2.39 0 C-N-CA 124.124 0.97 . . . . 0.0 109.645 171.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.516 ' HB2' ' O ' ' A' ' 84' ' ' ILE . 10.2 m-20 -97.86 -49.21 4.89 Favored 'General case' 0 CA--C 1.491 -1.295 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.06 -178.659 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . 0.675 ' O ' ' HA ' ' A' ' 86' ' ' GLU . 5.4 p90 -135.39 -165.87 1.75 Allowed 'General case' 0 C--O 1.16 -3.62 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 -175.214 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.579 ' O ' ' HA ' ' A' ' 32' ' ' LEU . 9.0 mt -147.05 149.75 15.4 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.316 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 169.261 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.411 HD23 ' CD1' ' A' ' 32' ' ' LEU . 37.2 mt -118.56 122.16 41.96 Favored 'General case' 0 N--CA 1.412 -2.34 0 O-C-N 124.453 1.096 . . . . 0.0 112.432 178.548 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.437 ' N ' HD13 ' A' ' 92' ' ' LEU . 1.7 mp -129.88 157.56 76.44 Favored Pre-proline 0 C--N 1.3 -1.546 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 -178.35 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -63.77 169.56 9.95 Favored 'Trans proline' 0 CA--C 1.5 -1.204 0 C-N-CA 122.442 2.095 . . . . 0.0 110.243 176.205 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 18.5 m -36.71 -56.4 0.84 Allowed 'General case' 0 C--N 1.322 -0.601 0 O-C-N 124.611 1.194 . . . . 0.0 110.738 170.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -59.2 -36.86 76.11 Favored 'General case' 0 C--O 1.199 -1.575 0 C-N-CA 124.812 1.245 . . . . 0.0 112.392 -174.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.561 ' O ' HD23 ' A' ' 100' ' ' LEU . . . -59.02 -62.74 5.88 Favored Glycine 0 N--CA 1.423 -2.23 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 179.363 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 68.8 t-105 -52.69 -49.79 64.6 Favored 'General case' 0 C--N 1.315 -0.893 0 C-N-CA 124.717 1.207 . . . . 0.0 110.488 177.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.463 ' O ' ' HB2' ' A' ' 102' ' ' SER . 34.4 t30 -53.49 -31.49 46.13 Favored 'General case' 0 N--CA 1.419 -2.014 0 C-N-CA 126.787 2.035 . . . . 0.0 111.962 178.339 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 52.7 mttm -78.22 -49.57 13.51 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-N 118.103 0.41 . . . . 0.0 110.402 174.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.561 HD23 ' O ' ' A' ' 96' ' ' GLY . 1.0 OUTLIER -57.4 -42.72 82.79 Favored 'General case' 0 C--O 1.24 0.567 0 CA-C-O 121.476 0.655 . . . . 0.0 111.362 -179.484 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 49.1 t -71.66 -27.99 29.79 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.809 0 C-N-CA 123.768 0.827 . . . . 0.0 111.091 177.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' SER . . . . . 0.463 ' HB2' ' O ' ' A' ' 98' ' ' ASN . 22.7 t -71.23 -34.08 70.46 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 178.65 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' TRP . . . . . 0.413 ' CH2' ' HA ' ' A' ' 12' ' ' GLN . 41.1 m0 -83.96 -54.0 5.17 Favored 'General case' 0 N--CA 1.423 -1.811 0 CA-C-N 115.266 -0.879 . . . . 0.0 112.239 -175.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -127.51 10.72 6.73 Favored 'General case' 0 CA--C 1.502 -0.88 0 N-CA-C 114.359 1.244 . . . . 0.0 114.359 -173.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 24.8 p 56.64 172.0 0.04 OUTLIER 'General case' 0 N--CA 1.411 -2.385 0 N-CA-C 116.774 2.139 . . . . 0.0 116.774 178.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.07 153.37 17.68 Favored 'General case' 0 C--N 1.282 -2.337 0 N-CA-C 105.831 -1.914 . . . . 0.0 105.831 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.459 ' HG3' ' HB2' ' A' ' 66' ' ' ASP . 65.3 mmm -64.62 156.17 30.94 Favored 'General case' 0 CA--C 1.493 -1.225 0 CA-C-O 121.299 0.571 . . . . 0.0 110.348 173.418 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -74.78 149.03 39.86 Favored 'General case' 0 N--CA 1.407 -2.609 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.043 -179.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 83.47 -34.55 2.89 Favored Glycine 0 N--CA 1.423 -2.183 0 CA-C-N 115.251 -0.886 . . . . 0.0 112.109 -178.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -79.0 150.67 31.89 Favored 'General case' 0 N--CA 1.411 -2.395 0 CA-C-O 121.302 0.573 . . . . 0.0 111.116 179.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -133.01 146.42 61.19 Favored Pre-proline 0 N--CA 1.406 -2.646 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -48.63 128.39 18.17 Favored 'Trans proline' 0 CA--C 1.467 -2.825 0 C-N-CA 124.097 3.198 . . . . 0.0 114.544 -174.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.422 HG21 HD12 ' A' ' 32' ' ' LEU . 45.9 mt -85.21 107.47 16.08 Favored 'Isoleucine or valine' 1 N--CA 1.371 -4.384 0 CA-C-N 113.28 -1.782 . . . . 0.0 106.879 175.809 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . 0.407 ' HB1' ' CG2' ' A' ' 29' ' ' THR . . . -103.86 135.64 45.03 Favored 'General case' 0 C--N 1.275 -2.656 0 CA-C-O 121.446 0.641 . . . . 0.0 110.823 -178.491 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.511 ' CB ' HD13 ' A' ' 32' ' ' LEU . 13.2 tpt180 -136.25 126.97 27.26 Favored 'General case' 0 CA--C 1.455 -2.697 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 179.151 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.84 -176.27 3.82 Favored 'General case' 0 C--N 1.253 -3.622 0 CA-C-O 123.358 1.552 . . . . 0.0 112.125 179.186 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.505 HG22 ' C ' ' A' ' 26' ' ' LYS . 9.0 m -66.71 -172.11 0.06 OUTLIER 'Isoleucine or valine' 1 N--CA 1.371 -4.394 0 CA-C-N 111.249 -2.705 . . . . 0.0 111.77 172.69 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 26.9 m -67.67 133.07 32.14 Favored 'Isoleucine or valine' 0 N--CA 1.395 -3.196 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.909 176.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -118.78 13.04 13.14 Favored 'General case' 0 C--N 1.275 -2.649 0 CA-C-O 123.033 1.397 . . . . 0.0 107.682 178.117 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 . . . . . 0 N--CA 1.427 -1.603 0 CA-C-N 112.527 -2.124 . . . . 0.0 111.057 -179.3 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.402 ' HE2' ' O ' ' A' ' 3' ' ' GLU . 22.5 ptm . . . . . 0 CA--C 1.503 -0.862 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -132.32 9.48 4.4 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-O 122.547 1.165 . . . . 0.0 108.535 175.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.402 ' O ' ' HE2' ' A' ' 1' ' ' MET . 0.1 OUTLIER -151.77 155.32 37.99 Favored 'General case' 0 C--N 1.285 -2.208 0 CA-C-N 113.457 -1.701 . . . . 0.0 107.195 -178.456 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 105.41 -133.42 11.57 Favored Glycine 0 N--CA 1.427 -1.964 0 C-N-CA 120.056 -1.069 . . . . 0.0 112.487 177.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 74.43 43.75 29.7 Favored Glycine 0 CA--C 1.483 -1.957 0 N-CA-C 107.088 -2.405 . . . . 0.0 107.088 -173.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.612 ' HA ' ' CD1' ' A' ' 103' ' ' TRP . . . -90.39 143.18 26.99 Favored 'General case' 0 N--CA 1.406 -2.641 0 CA-C-N 113.416 -1.392 . . . . 0.0 114.294 -169.709 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.451 ' HB2' ' CG2' ' A' ' 11' ' ' THR . . . -74.26 156.4 37.25 Favored 'General case' 0 N--CA 1.422 -1.844 0 CA-C-N 113.128 -1.851 . . . . 0.0 109.322 176.469 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.585 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 23.3 t70 -69.02 151.35 46.6 Favored 'General case' 0 C--O 1.194 -1.847 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 174.825 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -41.05 -52.49 3.18 Favored 'General case' 0 C--N 1.307 -1.258 0 C-N-CA 126.263 1.825 . . . . 0.0 112.447 177.373 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -68.91 -31.02 69.62 Favored 'General case' 0 C--N 1.271 -2.808 0 CA-C-N 113.593 -1.639 . . . . 0.0 110.221 -175.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.573 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 16.5 m -73.65 -44.3 57.18 Favored 'General case' 1 N--CA 1.377 -4.098 0 CA-C-N 114.57 -1.196 . . . . 0.0 110.786 177.847 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.585 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 45.9 mt-30 -56.78 -57.27 13.17 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 122.651 0.38 . . . . 0.0 111.589 -173.512 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.95 -41.37 64.44 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-O 121.151 0.501 . . . . 0.0 112.165 177.029 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.5 m -69.72 -47.16 64.09 Favored 'General case' 0 C--N 1.291 -1.965 0 CA-C-N 115.668 -0.697 . . . . 0.0 111.572 -178.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.554 ' O ' ' HB ' ' A' ' 18' ' ' THR . 13.5 t70 -61.31 -43.75 98.36 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 124.487 1.115 . . . . 0.0 110.64 -178.079 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.572 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 32.0 mm -72.88 -37.26 54.0 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.998 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.055 -178.375 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.454 ' O ' ' HG3' ' A' ' 21' ' ' LYS . . . -61.6 -36.99 82.27 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.554 ' HB ' ' O ' ' A' ' 15' ' ' ASP . 6.3 m -62.15 -33.99 75.55 Favored 'General case' 0 N--CA 1.408 -2.549 0 C-N-CA 125.898 1.679 . . . . 0.0 111.741 178.314 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 73.5 mt -85.79 -13.95 46.64 Favored 'General case' 0 C--N 1.27 -2.875 0 O-C-N 121.258 -0.901 . . . . 0.0 111.886 -177.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 14.3 mt -86.33 -26.88 24.64 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.611 0.72 . . . . 0.0 109.485 177.376 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.454 ' HG3' ' O ' ' A' ' 17' ' ' ALA . 0.1 OUTLIER -89.36 -7.66 54.81 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-O 122.35 1.071 . . . . 0.0 111.659 -174.507 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 15.2 m -75.73 136.71 40.32 Favored 'General case' 0 N--CA 1.386 -3.625 0 CA-C-N 113.207 -1.815 . . . . 0.0 110.729 176.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.5 m -75.03 142.86 43.75 Favored 'General case' 0 N--CA 1.403 -2.809 0 CA-C-N 113.724 -1.58 . . . . 0.0 111.549 178.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.519 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP . 0.5 OUTLIER -98.52 179.56 4.66 Favored 'General case' 0 N--CA 1.423 -1.812 0 N-CA-C 114.228 1.196 . . . . 0.0 114.228 -178.312 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.564 ' O ' HG23 ' A' ' 117' ' ' VAL . 3.6 mmp_? -127.23 -145.52 0.32 Allowed 'General case' 0 C--O 1.203 -1.383 0 C-N-CA 123.466 0.706 . . . . 0.0 110.894 -172.694 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -119.24 122.46 41.99 Favored 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 171.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 68.23 36.53 85.17 Favored Glycine 0 C--O 1.224 -0.493 0 N-CA-C 110.857 -0.897 . . . . 0.0 110.857 -177.086 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.415 ' HB2' ' HB2' ' A' ' 25' ' ' ARG . 34.1 t70 -79.23 -8.68 59.22 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-O 121.786 0.803 . . . . 0.0 111.989 -174.509 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.429 ' HA ' ' HA ' ' A' ' 116' ' ' LYS . 25.9 m 49.55 110.2 0.0 OUTLIER 'General case' 0 C--N 1.282 -2.344 0 C-N-CA 127.159 2.184 . . . . 0.0 114.369 -176.147 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.519 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 13.1 m95 -114.25 134.62 54.81 Favored 'General case' 0 C--N 1.3 -1.564 0 CA-C-N 114.693 -1.14 . . . . 0.0 109.172 -178.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -104.44 147.96 26.97 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 111.367 0.136 . . . . 0.0 111.367 -174.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.687 ' HA ' ' O ' ' A' ' 90' ' ' ILE . 5.8 mp -93.24 144.85 24.9 Favored 'General case' 0 CA--C 1.491 -1.307 0 N-CA-C 114.328 1.232 . . . . 0.0 114.328 -175.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 75.4 t -131.11 140.94 47.34 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.715 0 N-CA-C 105.871 -1.9 . . . . 0.0 105.871 173.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.409 ' HA ' HD13 ' A' ' 70' ' ' LEU . 20.1 t0 -64.62 131.61 47.47 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 173.689 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.487 ' O ' ' HE3' ' A' ' 39' ' ' LYS . 47.6 t -59.79 -37.54 79.39 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.262 -176.347 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 88.5 mtm180 -68.48 -34.31 75.71 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.848 -174.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.477 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 65.3 t90 -66.11 -46.37 77.84 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 177.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.52 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 32.7 t80 -64.7 -41.63 95.88 Favored 'General case' 0 C--O 1.206 -1.187 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.135 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.491 ' HG3' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.27 -38.98 69.28 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 118.394 0.543 . . . . 0.0 111.868 173.394 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.477 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 22.9 tp60 -65.58 -41.85 92.43 Favored 'General case' 0 N--CA 1.421 -1.906 0 CA-C-O 121.279 0.562 . . . . 0.0 109.854 175.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 77.1 t90 -63.09 -39.68 95.43 Favored 'General case' 0 N--CA 1.437 -1.097 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.001 178.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.52 ' HG3' ' O ' ' A' ' 38' ' ' PHE . 35.8 mtmt -57.65 -40.08 78.48 Favored 'General case' 0 CA--C 1.515 -0.396 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 178.518 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -61.24 -48.63 80.57 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.884 0.849 . . . . 0.0 109.862 176.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.572 ' O ' ' HA ' ' A' ' 55' ' ' MET . 2.1 t80 -66.48 -41.92 88.22 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 113.548 -1.66 . . . . 0.0 112.709 -175.458 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.439 ' CG1' ' HB2' ' A' ' 47' ' ' PHE . 1.6 p -90.54 -15.99 8.37 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.05 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.789 -173.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . 0.466 ' HA3' ' HB2' ' A' ' 52' ' ' LYS . . . 75.83 33.18 51.79 Favored Glycine 0 N--CA 1.416 -2.639 0 C-N-CA 121.249 -0.5 . . . . 0.0 112.119 -176.468 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.439 ' HB2' ' CG1' ' A' ' 45' ' ' VAL . 54.4 t80 -68.36 -45.48 72.68 Favored 'General case' 0 N--CA 1.44 -0.973 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.458 ' O ' ' HB3' ' A' ' 52' ' ' LYS . 70.2 m-20 -78.81 116.29 19.05 Favored 'General case' 0 CA--C 1.491 -1.29 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 178.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 36.0 m -66.63 -27.84 68.0 Favored 'General case' 0 C--N 1.291 -1.963 0 N-CA-C 111.8 0.296 . . . . 0.0 111.8 -178.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 45.0 p90 -82.57 -14.39 54.94 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.59 -178.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -154.53 101.06 2.31 Favored 'General case' 0 CA--C 1.488 -1.413 0 CA-C-O 121.417 0.627 . . . . 0.0 110.21 -179.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.466 ' HB2' ' HA3' ' A' ' 46' ' ' GLY . 22.8 pttp -156.91 21.41 0.32 Allowed 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 114.66 -1.154 . . . . 0.0 111.748 -171.387 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -70.79 -4.09 22.19 Favored 'General case' 0 C--N 1.266 -3.046 0 CA-C-N 114.503 -1.226 . . . . 0.0 110.177 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -106.87 11.71 29.71 Favored 'General case' 0 N--CA 1.403 -2.779 0 C-N-CA 124.467 1.107 . . . . 0.0 109.167 -177.3 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' MET . . . . . 0.572 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 50.0 ttm -60.98 103.56 0.28 Allowed 'General case' 0 N--CA 1.428 -1.555 0 C-N-CA 123.837 0.855 . . . . 0.0 110.914 179.56 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 89.54 15.69 58.04 Favored Glycine 0 N--CA 1.439 -1.117 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.873 -178.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.533 ' HB3' HG23 ' A' ' 60' ' ' VAL . 29.3 t0 -89.89 142.89 27.27 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 179.7 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -82.82 -16.25 48.48 Favored 'General case' 0 C--N 1.296 -1.72 0 CA-C-O 122.358 1.075 . . . . 0.0 109.061 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 66.3 m-20 -62.51 -26.3 68.47 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 114.317 -1.311 . . . . 0.0 111.171 175.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.533 HG23 ' HB3' ' A' ' 57' ' ' ASP . 27.3 m -123.33 1.95 5.78 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.693 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.113 -172.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -66.37 119.56 63.35 Favored Pre-proline 0 C--N 1.299 -1.594 0 C-N-CA 119.426 -0.91 . . . . 0.0 110.495 -178.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -87.22 117.07 1.25 Allowed 'Trans proline' 0 N--CA 1.413 -3.257 0 C-N-CA 122.529 2.153 . . . . 0.0 110.22 177.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -71.47 -145.35 0.41 Allowed Glycine 0 C--N 1.267 -3.26 0 CA-C-N 113.875 -1.511 . . . . 0.0 112.779 177.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -54.62 135.71 67.86 Favored 'Trans proline' 0 C--O 1.253 1.27 0 C-N-CA 123.001 2.468 . . . . 0.0 112.822 -177.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.44 HD13 ' HB3' ' A' ' 100' ' ' LEU . 57.2 mt -70.04 107.18 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.927 0 CA-C-N 115.133 -0.94 . . . . 0.0 112.029 -176.402 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -95.97 128.4 42.83 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.115 175.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.512 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 35.1 m-80 -124.21 11.82 8.83 Favored 'General case' 0 C--N 1.315 -0.933 0 O-C-N 123.96 0.787 . . . . 0.0 110.412 -179.006 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 23.0 t -59.95 -30.16 68.89 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -173.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -76.09 -13.28 83.37 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 121.479 -0.391 . . . . 0.0 112.547 -178.271 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.409 HD13 ' HA ' ' A' ' 34' ' ' ASP . 37.4 mt -91.08 -20.48 22.01 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.515 ' O ' ' HE2' ' A' ' 80' ' ' LYS . 44.9 mt -83.96 159.11 21.32 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.237 -170.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.439 ' HG3' ' C ' ' A' ' 79' ' ' LEU . 58.1 mtpt -87.46 -173.48 4.38 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-O 121.804 0.811 . . . . 0.0 111.797 178.636 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -95.8 109.6 21.89 Favored 'General case' 0 C--N 1.293 -1.86 0 CA-C-N 114.776 -1.102 . . . . 0.0 108.618 -175.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 124.88 -49.59 0.9 Allowed Glycine 0 N--CA 1.44 -1.07 0 C-N-CA 120.311 -0.947 . . . . 0.0 112.192 177.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -120.97 136.69 54.91 Favored 'General case' 0 CA--C 1.478 -1.808 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -89.82 4.75 48.84 Favored 'General case' 0 C--N 1.295 -1.761 0 CA-C-O 122.151 0.977 . . . . 0.0 109.509 178.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -112.68 2.85 16.29 Favored 'General case' 0 C--N 1.303 -1.44 0 CA-C-O 122.242 1.02 . . . . 0.0 108.506 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.2 t -113.56 140.68 47.96 Favored 'General case' 0 C--N 1.287 -2.12 0 N-CA-C 106.364 -1.717 . . . . 0.0 106.364 177.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.459 ' HA ' ' HA ' ' A' ' 71' ' ' LEU . 1.0 OUTLIER -126.41 153.84 44.44 Favored 'General case' 0 N--CA 1.409 -2.495 0 C-N-CA 120.719 -0.392 . . . . 0.0 110.391 -174.49 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.515 ' HE2' ' O ' ' A' ' 71' ' ' LEU . 66.2 mttm -55.25 144.23 25.34 Favored 'General case' 0 C--N 1.31 -1.144 0 N-CA-C 116.055 1.872 . . . . 0.0 116.055 -171.683 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -48.02 -58.24 4.71 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 127.218 2.207 . . . . 0.0 115.847 -172.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 41.4 m80 -91.84 -1.76 57.19 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 113.882 1.067 . . . . 0.0 113.882 -169.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.42 ' HB3' ' CD2' ' A' ' 89' ' ' TYR . 10.7 mp -59.98 127.5 32.21 Favored 'General case' 0 C--O 1.254 1.303 0 N-CA-C 115.307 1.595 . . . . 0.0 115.307 -176.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.411 HD12 HG22 ' A' ' 84' ' ' ILE . 61.8 mt -97.74 174.01 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 CA-C-N 112.67 -2.059 . . . . 0.0 107.029 177.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.555 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 18.3 t70 -61.59 -139.98 0.0 OUTLIER 'General case' 0 CA--C 1.581 2.173 0 C-N-CA 126.071 1.749 . . . . 0.0 110.684 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.615 ' HA ' ' O ' ' A' ' 89' ' ' TYR 0.252 0.2 OUTLIER -40.33 -18.86 0.01 OUTLIER 'General case' 0 N--CA 1.517 2.875 0 C-N-CA 127.333 2.253 . . . . 0.0 116.65 -171.811 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 54.7 mt -65.18 -59.15 4.41 Favored 'General case' 0 C--N 1.274 -2.678 0 C-N-CA 124.638 1.175 . . . . 0.0 110.847 172.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 36.4 m-20 -97.12 -39.18 9.43 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.709 -175.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . 0.615 ' O ' ' HA ' ' A' ' 86' ' ' GLU . 2.6 p90 -145.05 -164.34 1.91 Allowed 'General case' 0 C--O 1.162 -3.511 0 N-CA-C 105.172 -2.158 . . . . 0.0 105.172 -177.344 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.687 ' O ' ' HA ' ' A' ' 32' ' ' LEU . 3.1 mt -144.85 150.94 15.72 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.313 0 CA-C-N 120.25 1.386 . . . . 0.0 108.767 171.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.451 HD23 ' CD1' ' A' ' 32' ' ' LEU . 26.4 mt -119.98 117.98 29.47 Favored 'General case' 0 N--CA 1.393 -3.286 0 O-C-N 124.444 1.09 . . . . 0.0 110.936 175.829 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.472 ' HB3' ' HA2' ' A' ' 96' ' ' GLY . 1.2 mm? -111.95 161.14 27.15 Favored Pre-proline 0 CA--C 1.487 -1.48 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 177.334 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -59.78 168.22 5.87 Favored 'Trans proline' 0 C--O 1.257 1.432 0 C-N-CA 121.886 1.724 . . . . 0.0 108.158 165.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 34.1 m -50.89 -40.48 56.79 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 177.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -57.12 -52.71 64.19 Favored 'General case' 0 C--O 1.198 -1.635 0 C-N-CA 124.021 0.929 . . . . 0.0 111.522 177.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.528 ' O ' HD23 ' A' ' 100' ' ' LEU . . . -54.23 -57.61 16.2 Favored Glycine 0 CA--C 1.495 -1.211 0 O-C-N 124.049 0.843 . . . . 0.0 112.082 -175.033 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 47.8 t-105 -53.66 -51.02 64.49 Favored 'General case' 0 C--N 1.289 -2.027 0 C-N-CA 123.512 0.725 . . . . 0.0 111.287 174.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -55.03 -28.79 54.9 Favored 'General case' 0 C--O 1.195 -1.782 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 175.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.635 ' HB3' ' CH2' ' A' ' 103' ' ' TRP . 19.0 mmtp -69.76 -57.14 5.47 Favored 'General case' 0 N--CA 1.41 -2.465 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 177.257 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.528 HD23 ' O ' ' A' ' 96' ' ' GLY . 0.5 OUTLIER -58.88 -39.22 80.74 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.918 -176.94 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.519 ' O ' ' HA ' ' A' ' 105' ' ' THR . 55.2 t -75.6 -26.71 18.36 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.377 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.817 177.268 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 25.9 t -73.73 -39.08 64.53 Favored 'General case' 0 C--N 1.296 -1.725 0 O-C-N 120.96 -1.087 . . . . 0.0 108.583 176.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' TRP . . . . . 0.635 ' CH2' ' HB3' ' A' ' 99' ' ' LYS . 26.1 m0 -79.35 -49.51 12.29 Favored 'General case' 0 N--CA 1.437 -1.097 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.954 -174.369 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 64.5 m-85 -126.84 8.62 6.85 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 114.108 1.151 . . . . 0.0 114.108 -176.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.519 ' HA ' ' O ' ' A' ' 101' ' ' VAL 0.268 6.0 t 49.63 -174.58 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 126.608 1.963 . . . . 0.0 115.584 179.538 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -98.34 157.43 16.19 Favored 'General case' 0 C--N 1.247 -3.862 0 CA-C-N 112.733 -2.031 . . . . 0.0 107.45 -174.421 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 23.2 tpp -74.57 137.96 42.73 Favored 'General case' 1 N--CA 1.369 -4.475 0 CA-C-O 121.749 0.785 . . . . 0.0 109.311 175.372 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -63.35 123.49 18.83 Favored 'General case' 1 N--CA 1.362 -4.844 0 C-N-CA 126.188 1.795 . . . . 0.0 110.583 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 107.97 -15.25 37.12 Favored Glycine 0 N--CA 1.421 -2.31 0 CA-C-N 113.809 -1.541 . . . . 0.0 111.039 -177.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -104.02 156.74 17.61 Favored 'General case' 0 N--CA 1.434 -1.23 0 CA-C-O 121.885 0.85 . . . . 0.0 112.426 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -134.72 141.31 38.18 Favored Pre-proline 0 C--N 1.292 -1.919 0 N-CA-C 106.119 -1.808 . . . . 0.0 106.119 -177.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -48.73 125.34 12.57 Favored 'Trans proline' 0 CA--C 1.47 -2.684 0 C-N-CA 123.962 3.108 . . . . 0.0 115.263 -172.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.426 HG12 HD22 ' A' ' 71' ' ' LEU . 3.7 mp -90.73 109.22 20.64 Favored 'Isoleucine or valine' 1 N--CA 1.377 -4.092 0 CA-C-N 112.411 -2.177 . . . . 0.0 106.011 177.43 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -108.69 138.74 44.53 Favored 'General case' 0 C--N 1.281 -2.387 0 CA-C-O 121.927 0.87 . . . . 0.0 112.397 -177.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.531 ' CG ' HD12 ' A' ' 32' ' ' LEU . 11.8 mmm180 -120.57 -172.12 2.31 Favored 'General case' 0 C--N 1.282 -2.346 0 N-CA-C 104.126 -2.546 . . . . 0.0 104.126 173.031 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 29' ' ' THR . 24.4 pttm -135.48 -167.31 1.99 Allowed 'General case' 0 C--N 1.247 -3.871 0 N-CA-C 107.353 -1.351 . . . . 0.0 107.353 176.167 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.564 HG23 ' O ' ' A' ' 25' ' ' ARG . 59.4 t -60.26 134.22 25.59 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.291 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 171.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 19.2 m -73.6 -178.82 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.271 -2.813 0 N-CA-C 115.568 1.692 . . . . 0.0 115.568 -166.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -57.85 -44.04 86.29 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-N 114.015 -1.448 . . . . 0.0 111.431 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 19.7 pt20 . . . . . 0 C--O 1.248 1.021 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.712 -176.552 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.2 mtt . . . . . 0 CA--C 1.503 -0.842 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -143.71 98.15 3.19 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 176.194 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -93.88 114.56 26.81 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 -179.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -78.39 74.99 2.0 Favored Glycine 0 C--N 1.309 -0.945 0 CA-C-N 116.251 -0.431 . . . . 0.0 112.687 -177.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -144.04 57.27 0.54 Allowed Glycine 0 CA--C 1.488 -1.653 0 N-CA-C 110.707 -0.957 . . . . 0.0 110.707 178.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.589 ' HA ' ' CD1' ' A' ' 103' ' ' TRP . . . -106.31 144.78 32.51 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-O 121.596 0.712 . . . . 0.0 111.868 -178.133 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.47 ' HB2' ' CG2' ' A' ' 11' ' ' THR . . . -68.77 172.93 5.72 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 113.879 -1.51 . . . . 0.0 111.307 178.584 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.518 ' O ' ' HB ' ' A' ' 11' ' ' THR . 21.2 t70 -74.7 149.25 39.95 Favored 'General case' 0 C--O 1.199 -1.57 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.378 178.246 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.404 ' HA ' ' HG3' ' A' ' 12' ' ' GLN . 18.7 mt -51.43 -38.53 54.08 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.635 0.774 . . . . 0.0 111.2 -177.47 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -67.51 -38.65 84.59 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-N 113.684 -1.598 . . . . 0.0 109.227 -176.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.518 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 8.2 m -74.05 -48.3 30.83 Favored 'General case' 0 N--CA 1.38 -3.929 0 CA-C-N 113.604 -1.634 . . . . 0.0 110.597 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.477 ' HA ' ' CH2' ' A' ' 103' ' ' TRP . 14.5 mt-30 -52.51 -54.29 34.52 Favored 'General case' 0 CA--C 1.48 -1.721 0 O-C-N 123.903 0.752 . . . . 0.0 110.561 -174.688 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.65 ' HD2' ' CH2' ' A' ' 41' ' ' TRP . 4.0 mmm180 -70.6 -32.32 69.62 Favored 'General case' 0 CA--C 1.452 -2.797 0 N-CA-C 115.627 1.714 . . . . 0.0 115.627 -176.081 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 33.8 t -72.02 -45.54 60.5 Favored 'General case' 0 C--N 1.273 -2.72 0 O-C-N 123.971 0.794 . . . . 0.0 110.063 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -70.45 -31.41 68.57 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.927 -175.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.521 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 3.7 mm -80.88 -42.97 20.71 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.714 0 CA-C-N 115.297 -0.865 . . . . 0.0 112.222 176.606 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.546 ' O ' ' HG2' ' A' ' 21' ' ' LYS . . . -55.47 -37.29 67.6 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.473 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.444 ' HA ' ' HD3' ' A' ' 21' ' ' LYS . 1.2 m -63.1 -34.55 77.83 Favored 'General case' 0 N--CA 1.405 -2.718 0 CA-C-N 113.75 -1.568 . . . . 0.0 112.276 -179.284 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 82.9 mt -86.09 -14.03 45.48 Favored 'General case' 0 C--N 1.275 -2.643 0 O-C-N 121.694 -0.629 . . . . 0.0 112.305 -176.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 20.4 mt -84.11 -28.24 27.63 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 178.233 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.546 ' HG2' ' O ' ' A' ' 17' ' ' ALA . 19.2 ptmt -88.47 -23.35 23.27 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 114.705 -1.134 . . . . 0.0 110.945 -175.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.2 m -57.4 141.55 46.89 Favored 'General case' 0 N--CA 1.404 -2.761 0 C-N-CA 125.24 1.416 . . . . 0.0 111.233 173.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.3 m -87.33 170.11 11.69 Favored 'General case' 0 N--CA 1.403 -2.777 0 CA-C-N 114.027 -1.442 . . . . 0.0 111.969 -176.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.504 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP . 0.7 OUTLIER -112.78 163.91 14.02 Favored 'General case' 0 N--CA 1.408 -2.569 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 178.003 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 28.3 mmt180 -104.59 -159.55 0.72 Allowed 'General case' 0 C--N 1.297 -1.675 0 CA-C-N 114.514 -1.221 . . . . 0.0 108.186 176.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.411 ' HZ1' ' C ' ' A' ' 120' ' ' GLN . 21.4 ttmm -109.64 18.72 19.98 Favored 'General case' 0 N--CA 1.42 -1.963 0 N-CA-C 106.808 -1.552 . . . . 0.0 106.808 175.615 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.472 ' N ' HG22 ' A' ' 117' ' ' VAL . . . -155.85 29.65 0.6 Allowed Glycine 0 N--CA 1.427 -1.959 0 CA-C-N 114.284 -1.326 . . . . 0.0 112.915 179.182 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.442 ' HB2' ' CG1' ' A' ' 117' ' ' VAL . 57.2 m-20 -95.69 153.36 17.77 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 119.189 -1.004 . . . . 0.0 109.6 176.223 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 98.9 m -104.99 129.21 53.48 Favored 'General case' 0 C--N 1.287 -2.122 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 174.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.504 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 40.9 m95 -116.51 139.11 50.83 Favored 'General case' 0 C--N 1.297 -1.696 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -178.772 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.455 ' CE1' ' HA ' ' A' ' 94' ' ' THR . 72.3 m-85 -104.92 141.78 35.94 Favored 'General case' 0 C--N 1.276 -2.63 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.305 -176.013 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.498 ' HA ' ' O ' ' A' ' 90' ' ' ILE . 6.0 mp -89.65 136.87 32.78 Favored 'General case' 0 CA--C 1.49 -1.344 0 O-C-N 124.383 1.052 . . . . 0.0 111.513 179.67 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.437 HG13 ' O ' ' A' ' 34' ' ' ASP . 81.7 t -121.74 140.36 45.98 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.868 0 N-CA-C 104.41 -2.441 . . . . 0.0 104.41 172.339 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.489 ' OD2' ' HB2' ' A' ' 36' ' ' ARG . 5.5 p-10 -69.69 127.38 32.76 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 106.153 -1.795 . . . . 0.0 106.153 172.157 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 69.6 p -67.37 -19.19 65.39 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-O 121.565 0.698 . . . . 0.0 110.899 -172.407 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.489 ' HB2' ' OD2' ' A' ' 34' ' ' ASP . 44.5 mtt180 -63.9 -48.06 78.14 Favored 'General case' 0 C--N 1.285 -2.235 0 C-N-CA 125.51 1.524 . . . . 0.0 108.29 -177.023 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.458 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 73.6 t90 -63.84 -48.09 78.18 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 124.597 1.159 . . . . 0.0 108.803 177.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 23.3 t80 -61.86 -40.04 93.95 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 114.858 -1.064 . . . . 0.0 111.614 -177.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.412 ' HA ' ' HD3' ' A' ' 42' ' ' LYS . 94.8 mttt -67.02 -34.36 77.56 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 175.649 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.458 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 23.8 tp60 -65.55 -42.39 91.94 Favored 'General case' 0 N--CA 1.423 -1.796 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 175.068 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.65 ' CH2' ' HD2' ' A' ' 13' ' ' ARG . 47.8 t90 -66.04 -37.81 86.79 Favored 'General case' 0 N--CA 1.436 -1.14 0 CA-C-N 114.256 -1.338 . . . . 0.0 110.036 179.805 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.412 ' HD3' ' HA ' ' A' ' 39' ' ' LYS . 12.0 mtpp -53.72 -45.52 70.5 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.746 0.818 . . . . 0.0 113.177 175.195 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.459 ' HG2' ' OD2' ' A' ' 51' ' ' ASP . 51.5 mttm -65.31 -46.25 81.07 Favored 'General case' 0 CA--C 1.507 -0.676 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 177.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -55.29 -33.09 62.93 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 114.306 -1.315 . . . . 0.0 113.539 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.637 HG21 ' O ' ' A' ' 41' ' ' TRP . 5.7 m -102.45 -11.75 8.92 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -179.392 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . 0.447 ' HA3' ' HB2' ' A' ' 52' ' ' LYS . . . 71.71 43.41 51.56 Favored Glycine 0 N--CA 1.415 -2.707 0 C-N-CA 120.003 -1.094 . . . . 0.0 111.554 -175.445 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -66.77 -45.1 79.57 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 176.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -83.44 153.87 24.25 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 115.225 -0.898 . . . . 0.0 108.958 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 5.4 p -84.51 -48.8 9.22 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-O 121.227 0.536 . . . . 0.0 111.921 -179.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 46.6 p90 -73.67 -16.6 61.21 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.752 -177.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.459 ' OD2' ' HG2' ' A' ' 43' ' ' LYS . 30.7 t70 -135.37 87.34 2.32 Favored 'General case' 0 CA--C 1.474 -1.954 0 CA-C-O 121.956 0.884 . . . . 0.0 111.159 -174.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.447 ' HB2' ' HA3' ' A' ' 46' ' ' GLY . 64.7 pttt -157.5 15.47 0.25 Allowed 'General case' 0 N--CA 1.429 -1.483 0 CA-C-N 113.835 -1.53 . . . . 0.0 112.236 -176.305 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 87.5 m-85 -64.1 -10.0 19.82 Favored 'General case' 0 C--N 1.292 -1.927 0 CA-C-N 114.922 -1.036 . . . . 0.0 110.356 173.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.463 ' HB3' HG13 ' A' ' 60' ' ' VAL . 11.0 mm100 -100.72 3.23 42.12 Favored 'General case' 0 N--CA 1.405 -2.724 0 C-N-CA 125.396 1.478 . . . . 0.0 110.753 -176.647 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 48.7 ttp -65.09 109.13 2.05 Favored 'General case' 0 N--CA 1.426 -1.631 0 CA-C-O 121.227 0.537 . . . . 0.0 111.818 -176.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 89.95 2.36 75.04 Favored Glycine 0 N--CA 1.429 -1.777 0 CA-C-N 114.357 -1.292 . . . . 0.0 111.756 -178.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.466 ' HB3' HG23 ' A' ' 60' ' ' VAL . 4.8 t70 -77.28 152.27 34.68 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 -177.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.454 ' O ' ' HD2' ' A' ' 61' ' ' TYR . 20.7 pt20 -84.15 -24.32 30.27 Favored 'General case' 0 C--N 1.292 -1.895 0 CA-C-O 121.609 0.719 . . . . 0.0 109.809 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -61.13 -21.1 63.42 Favored 'General case' 0 CA--C 1.498 -1.039 0 CA-C-N 115.351 -0.84 . . . . 0.0 112.015 -179.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.466 HG23 ' HB3' ' A' ' 57' ' ' ASP . 28.8 m -119.47 2.39 7.18 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.073 0 CA-C-N 115.19 -0.914 . . . . 0.0 112.359 -173.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.454 ' HD2' ' O ' ' A' ' 58' ' ' GLN . 0.9 OUTLIER -65.3 114.63 16.19 Favored Pre-proline 0 C--N 1.314 -0.978 0 O-C-N 124.121 0.888 . . . . 0.0 110.504 -177.552 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -89.86 113.33 0.53 Allowed 'Trans proline' 0 N--CA 1.419 -2.871 0 C-N-CA 122.491 2.128 . . . . 0.0 109.688 177.052 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -70.64 -140.05 0.18 Allowed Glycine 0 C--N 1.281 -2.514 0 CA-C-N 114.923 -1.035 . . . . 0.0 113.163 177.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.431 ' HA ' ' O ' ' A' ' 104' ' ' TYR . 11.8 Cg_endo -56.16 145.24 77.28 Favored 'Trans proline' 0 C--O 1.252 1.205 0 C-N-CA 122.67 2.247 . . . . 0.0 112.739 -178.2 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 60.9 mt -72.63 117.09 15.67 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.98 -178.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.535 ' HB2' ' HG3' ' A' ' 107' ' ' MET . 17.0 t0 -116.33 104.53 11.57 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-O 121.896 0.855 . . . . 0.0 111.384 178.389 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.645 ' O ' HD22 ' A' ' 71' ' ' LEU . 42.9 m-80 -92.91 5.86 49.86 Favored 'General case' 0 C--N 1.284 -2.245 0 CA-C-N 114.899 -1.046 . . . . 0.0 111.04 -178.621 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 19.2 t -72.74 83.89 1.18 Allowed 'General case' 0 N--CA 1.445 -0.676 0 CA-C-O 122.523 1.154 . . . . 0.0 107.899 177.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 169.25 -20.74 0.08 OUTLIER Glycine 0 N--CA 1.42 -2.414 0 N-CA-C 108.45 -1.86 . . . . 0.0 108.45 -175.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 79.2 mt -88.41 -29.53 20.16 Favored 'General case' 0 CA--C 1.484 -1.568 0 N-CA-C 104.667 -2.345 . . . . 0.0 104.667 171.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.645 HD22 ' O ' ' A' ' 67' ' ' ASN . 2.2 mm? -75.88 156.79 33.99 Favored 'General case' 0 N--CA 1.38 -3.959 0 CA-C-N 110.781 -2.918 . . . . 0.0 107.084 173.114 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.449 ' HG3' ' O ' ' A' ' 78' ' ' SER . 38.0 mtpt -64.22 -176.95 0.24 Allowed 'General case' 0 C--N 1.292 -1.892 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 -174.621 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -62.82 -23.73 67.41 Favored 'General case' 0 CA--C 1.487 -1.444 0 N-CA-C 114.343 1.238 . . . . 0.0 114.343 -169.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -149.73 39.66 0.89 Allowed Glycine 0 N--CA 1.404 -3.464 0 C-N-CA 119.192 -1.48 . . . . 0.0 111.575 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -142.23 151.99 42.65 Favored 'General case' 0 CA--C 1.484 -1.558 0 CA-C-N 115.682 -0.259 . . . . 0.0 110.427 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -119.23 -1.86 10.77 Favored 'General case' 0 C--N 1.3 -1.554 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.71 177.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.555 HE21 ' HA ' ' A' ' 77' ' ' GLN . 0.0 OUTLIER -116.9 -14.17 10.67 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-O 121.732 0.777 . . . . 0.0 110.175 179.927 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.449 ' O ' ' HG3' ' A' ' 72' ' ' LYS . 20.2 m -108.15 119.71 40.27 Favored 'General case' 0 C--N 1.299 -1.629 0 CA-C-N 114.81 -1.086 . . . . 0.0 110.845 -175.276 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.412 ' HA ' ' HA ' ' A' ' 71' ' ' LEU . 3.0 mm? -81.58 148.8 28.93 Favored 'General case' 0 N--CA 1.437 -1.087 0 C-N-CA 123.914 0.886 . . . . 0.0 111.986 -179.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -63.68 151.9 40.59 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.557 176.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -75.1 -35.83 61.72 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-O 122.145 0.974 . . . . 0.0 108.653 -178.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 15.4 t-80 -88.07 12.8 12.58 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-N 114.486 -1.234 . . . . 0.0 112.795 -170.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.406 ' HB3' ' CE2' ' A' ' 89' ' ' TYR . 43.2 mt -57.23 141.63 45.88 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 114.263 1.208 . . . . 0.0 114.263 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.476 HG22 HD11 ' A' ' 84' ' ' ILE . 62.8 mt -137.14 166.49 25.37 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 N-CA-C 106.251 -1.759 . . . . 0.0 106.251 -178.519 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.618 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 17.7 t70 -62.55 -146.22 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.213 0 C-N-CA 125.582 1.553 . . . . 0.0 110.586 -178.097 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.71 ' HA ' ' O ' ' A' ' 89' ' ' TYR 0.271 0.0 OUTLIER -40.74 -18.19 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.662 0 N-CA-C 117.014 2.228 . . . . 0.0 117.014 -174.029 . . . . . . . . 4 4 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.47 HD11 HG22 ' A' ' 84' ' ' ILE . 44.4 mt -61.02 -61.03 2.87 Favored 'General case' 0 C--N 1.281 -2.411 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.838 170.113 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -97.83 -41.19 8.16 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 -176.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . 0.71 ' O ' ' HA ' ' A' ' 86' ' ' GLU . 1.3 p90 -139.9 -169.15 2.66 Favored 'General case' 0 C--O 1.155 -3.892 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.571 -174.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.498 ' O ' ' HA ' ' A' ' 32' ' ' LEU . 10.3 mt -146.21 153.01 13.41 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.343 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 170.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.443 ' N ' HG21 ' A' ' 90' ' ' ILE . 81.7 mt -117.73 134.69 54.65 Favored 'General case' 0 N--CA 1.413 -2.302 0 O-C-N 124.2 0.938 . . . . 0.0 110.907 177.14 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.406 ' N ' HD13 ' A' ' 92' ' ' LEU . 1.8 mp -140.2 159.53 63.53 Favored Pre-proline 0 C--N 1.291 -1.971 0 N-CA-C 106.794 -1.558 . . . . 0.0 106.794 -177.516 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -63.46 168.75 10.8 Favored 'Trans proline' 0 C--O 1.256 1.389 0 C-N-CA 121.992 1.795 . . . . 0.0 110.251 175.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.455 ' HA ' ' CE1' ' A' ' 31' ' ' TYR . 33.0 m -42.8 -47.95 5.59 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 124.532 1.145 . . . . 0.0 110.799 172.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -66.21 -38.15 87.26 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-N 114.613 -1.176 . . . . 0.0 112.33 -175.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.461 ' O ' ' HG ' ' A' ' 100' ' ' LEU . . . -62.18 -51.3 57.64 Favored Glycine 0 N--CA 1.429 -1.815 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 -179.278 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.412 ' CE2' ' HB3' ' A' ' 112' ' ' PRO . 69.1 t-105 -57.54 -50.04 74.38 Favored 'General case' 0 N--CA 1.428 -1.566 0 CA-C-N 114.594 -0.803 . . . . 0.0 110.35 174.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -48.26 -45.22 34.28 Favored 'General case' 0 CA--C 1.489 -1.368 0 O-C-N 123.788 0.68 . . . . 0.0 111.621 176.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 60.5 mttm -66.4 -45.27 80.55 Favored 'General case' 0 N--CA 1.426 -1.639 0 CA-C-O 120.639 0.257 . . . . 0.0 110.625 -177.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' A' ' 96' ' ' GLY . 64.9 mt -65.1 -34.23 77.92 Favored 'General case' 0 C--N 1.292 -1.934 0 CA-C-O 121.403 0.62 . . . . 0.0 111.289 -178.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.441 ' HA ' ' HA ' ' A' ' 105' ' ' THR . 8.8 t -78.84 -23.8 13.0 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.456 0 CA-C-O 121.771 0.796 . . . . 0.0 111.12 176.594 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 67.1 m -73.51 -37.98 65.5 Favored 'General case' 0 N--CA 1.418 -2.031 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 174.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' TRP . . . . . 0.589 ' CD1' ' HA ' ' A' ' 6' ' ' ALA . 44.8 m0 -84.34 -42.44 15.75 Favored 'General case' 0 N--CA 1.424 -1.758 0 CA-C-N 114.995 -1.002 . . . . 0.0 112.959 -174.28 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' TYR . . . . . 0.431 ' O ' ' HA ' ' A' ' 64' ' ' PRO . 73.1 m-85 -127.63 -5.28 5.84 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 111.817 0.303 . . . . 0.0 111.817 -174.418 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.441 ' HA ' ' HA ' ' A' ' 101' ' ' VAL 0.288 13.7 t 50.62 -174.11 0.02 OUTLIER 'General case' 0 C--O 1.247 0.927 0 C-N-CA 125.788 1.635 . . . . 0.0 113.979 -173.69 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.454 ' HG ' ' N ' ' A' ' 107' ' ' MET . 37.1 tp -107.13 149.85 27.21 Favored 'General case' 0 C--N 1.244 -3.996 0 CA-C-N 113.305 -1.77 . . . . 0.0 109.057 -177.419 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.535 ' HG3' ' HB2' ' A' ' 66' ' ' ASP . 80.3 mmm -59.38 154.37 16.99 Favored 'General case' 0 CA--C 1.492 -1.267 0 CA-C-O 122.131 0.967 . . . . 0.0 111.039 173.236 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -76.57 140.31 41.02 Favored 'General case' 0 N--CA 1.396 -3.165 0 CA-C-N 114.468 -1.242 . . . . 0.0 111.322 -176.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 88.84 -25.9 9.15 Favored Glycine 0 N--CA 1.412 -2.904 0 CA-C-N 114.743 -1.117 . . . . 0.0 113.667 175.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -92.01 172.19 8.61 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 119.681 -0.808 . . . . 0.0 109.355 -177.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -121.67 158.33 54.46 Favored Pre-proline 0 N--CA 1.432 -1.352 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -177.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . 0.412 ' HB3' ' CE2' ' A' ' 97' ' ' TRP . 22.9 Cg_exo -67.79 122.39 9.54 Favored 'Trans proline' 0 CA--C 1.448 -3.792 0 C-N-CA 122.358 2.039 . . . . 0.0 109.174 169.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 3.3 mp -82.79 109.33 16.55 Favored 'Isoleucine or valine' 1 N--CA 1.375 -4.208 0 CA-C-N 114.322 -1.308 . . . . 0.0 108.057 -178.637 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -102.13 137.98 39.69 Favored 'General case' 0 C--N 1.277 -2.574 0 CA-C-N 115.472 -0.786 . . . . 0.0 109.975 179.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.426 ' HB2' HD13 ' A' ' 32' ' ' LEU . 5.7 tpt180 -135.34 -178.71 5.23 Favored 'General case' 0 N--CA 1.402 -2.857 0 N-CA-C 103.841 -2.651 . . . . 0.0 103.841 178.269 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.401 ' H ' ' HG3' ' A' ' 115' ' ' ARG . 16.9 ptpt -137.03 179.27 6.48 Favored 'General case' 0 N--CA 1.402 -2.87 0 C-N-CA 118.217 -1.393 . . . . 0.0 113.27 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.472 HG22 ' N ' ' A' ' 27' ' ' GLY . 7.3 m -60.4 -176.85 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.383 -3.793 0 CA-C-N 111.408 -2.633 . . . . 0.0 112.915 174.083 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 30.8 m -71.87 146.04 11.76 Favored 'Isoleucine or valine' 0 N--CA 1.386 -3.657 0 CA-C-N 114.894 -1.048 . . . . 0.0 109.783 175.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -102.47 7.71 40.2 Favored 'General case' 0 C--N 1.273 -2.759 0 CA-C-N 114.258 -1.337 . . . . 0.0 109.409 -176.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.411 ' C ' ' HZ1' ' A' ' 26' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.412 -2.332 0 CA-C-N 114.347 -1.297 . . . . 0.0 109.151 -178.053 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.406 ' HE1' ' HB2' ' A' ' 108' ' ' GLU . 1.5 mpt? . . . . . 0 CA--C 1.501 -0.927 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -135.38 152.37 51.36 Favored 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 58.88 85.84 0.09 Allowed 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -101.51 60.56 0.59 Allowed Glycine 0 N--CA 1.434 -1.476 0 N-CA-C 109.358 -1.497 . . . . 0.0 109.358 175.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -80.78 88.07 1.34 Allowed Glycine 0 CA--C 1.485 -1.792 0 N-CA-C 110.694 -0.962 . . . . 0.0 110.694 -177.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.659 ' HA ' ' CD1' ' A' ' 103' ' ' TRP . . . -97.1 143.84 27.53 Favored 'General case' 0 N--CA 1.422 -1.874 0 CA-C-O 121.205 0.526 . . . . 0.0 112.416 -177.117 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.453 ' HB2' ' CG2' ' A' ' 11' ' ' THR . . . -72.74 175.9 6.04 Favored 'General case' 0 CA--C 1.502 -0.887 0 CA-C-N 114.281 -1.327 . . . . 0.0 109.613 175.153 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.669 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 13.8 t70 -69.14 145.46 53.32 Favored 'General case' 0 CA--C 1.467 -2.213 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 177.611 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -40.75 -51.53 3.07 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 126.083 1.753 . . . . 0.0 112.579 178.043 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -76.07 -31.55 58.83 Favored 'General case' 0 C--N 1.276 -2.587 0 CA-C-N 113.638 -1.619 . . . . 0.0 110.771 -176.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.51 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 3.7 m -65.14 -46.29 81.54 Favored 'General case' 0 N--CA 1.4 -2.94 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 177.271 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.669 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 53.7 mt-30 -54.66 -44.14 73.0 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-N 114.848 -1.069 . . . . 0.0 109.413 -179.081 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.477 ' CG ' ' HB ' ' A' ' 45' ' ' VAL . 3.2 mmp_? -70.32 -41.4 73.32 Favored 'General case' 0 N--CA 1.411 -2.387 0 N-CA-C 113.412 0.894 . . . . 0.0 113.412 -178.472 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.2 m -64.36 -46.3 84.02 Favored 'General case' 0 C--N 1.251 -3.683 0 CA-C-O 121.414 0.626 . . . . 0.0 110.484 -178.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.435 ' O ' ' HB ' ' A' ' 18' ' ' THR . 51.3 t0 -67.72 -46.83 71.07 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 114.659 -1.155 . . . . 0.0 109.671 -177.75 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.64 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 21.6 mm -71.94 -39.39 66.82 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.58 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.993 -177.449 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.509 ' O ' ' HG2' ' A' ' 21' ' ' LYS . . . -58.61 -34.8 71.54 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 -179.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.514 ' HA ' ' CE ' ' A' ' 21' ' ' LYS . 2.9 m -66.94 -42.07 85.92 Favored 'General case' 0 N--CA 1.4 -2.943 0 CA-C-N 113.975 -1.466 . . . . 0.0 111.905 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 82.0 mt -78.77 -12.67 60.03 Favored 'General case' 0 C--N 1.268 -2.962 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -175.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.64 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 20.6 mt -82.17 -31.48 30.42 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.098 -0.705 . . . . 0.0 109.098 176.264 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.514 ' CE ' ' HA ' ' A' ' 18' ' ' THR . 48.2 pttt -92.69 -25.93 18.02 Favored 'General case' 0 N--CA 1.425 -1.723 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.439 -174.101 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 31.8 m -67.73 137.67 55.66 Favored 'General case' 0 N--CA 1.398 -3.045 0 CA-C-O 122.336 1.065 . . . . 0.0 112.089 177.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.469 ' HA ' HD11 ' A' ' 24' ' ' LEU . 36.8 t -94.77 167.68 11.29 Favored 'General case' 0 N--CA 1.391 -3.421 0 CA-C-N 112.928 -1.942 . . . . 0.0 109.306 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.587 HD11 ' N ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -105.19 177.95 4.7 Favored 'General case' 1 N--CA 1.377 -4.101 0 CA-C-N 112.834 -1.985 . . . . 0.0 114.301 -167.267 . . . . . . . . 4 4 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.623 ' O ' HG23 ' A' ' 117' ' ' VAL . 25.1 mmt180 -134.13 143.24 47.83 Favored 'General case' 0 C--N 1.285 -2.215 0 CA-C-N 112.643 -2.071 . . . . 0.0 106.834 175.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 44.0 mtpt -67.9 95.19 0.51 Allowed 'General case' 0 C--N 1.306 -1.319 0 CA-C-O 121.808 0.813 . . . . 0.0 109.596 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 143.37 19.52 0.22 Allowed Glycine 0 N--CA 1.426 -1.971 0 CA-C-N 114.17 -1.377 . . . . 0.0 110.554 -174.355 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -103.58 -179.63 4.0 Favored 'General case' 0 CA--C 1.499 -1.008 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 176.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 86.1 m -140.97 127.3 19.79 Favored 'General case' 0 N--CA 1.42 -1.958 0 N-CA-C 106.576 -1.638 . . . . 0.0 106.576 176.015 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.457 ' CZ2' HD13 ' A' ' 24' ' ' LEU . 42.2 m95 -112.84 119.4 37.88 Favored 'General case' 0 C--N 1.301 -1.502 0 CA-C-O 121.021 0.439 . . . . 0.0 109.988 -177.172 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 86.5 m-85 -94.36 148.67 21.99 Favored 'General case' 0 C--N 1.277 -2.545 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.594 -176.154 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.594 ' HA ' ' O ' ' A' ' 90' ' ' ILE . 6.2 mp -98.1 139.72 33.49 Favored 'General case' 0 CA--C 1.475 -1.932 0 O-C-N 124.042 0.839 . . . . 0.0 111.008 178.567 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.442 ' HA ' ' OD1' ' A' ' 67' ' ' ASN . 59.4 t -118.44 138.68 48.37 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.878 0 N-CA-C 105.52 -2.03 . . . . 0.0 105.52 172.343 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.494 ' OD1' ' HG2' ' A' ' 36' ' ' ARG . 19.5 t0 -63.8 128.7 36.98 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 106.86 -1.533 . . . . 0.0 106.86 171.777 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 83.0 p -68.15 -27.12 66.15 Favored 'General case' 0 C--O 1.193 -1.91 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 -170.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.494 ' HG2' ' OD1' ' A' ' 34' ' ' ASP . 19.1 mmt180 -64.59 -39.34 93.55 Favored 'General case' 0 N--CA 1.433 -1.322 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.329 -175.774 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.48 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 66.8 t90 -68.41 -47.27 67.72 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 178.019 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.448 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 39.3 t80 -60.72 -39.71 89.63 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.422 -179.831 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.441 ' HA ' ' HE3' ' A' ' 42' ' ' LYS . 93.1 mttt -66.36 -32.29 73.59 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 122.819 0.448 . . . . 0.0 111.98 176.795 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.48 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 19.7 tp60 -68.94 -42.02 77.29 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 174.104 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.621 ' O ' HG23 ' A' ' 45' ' ' VAL . 52.9 t90 -64.45 -37.27 86.96 Favored 'General case' 0 N--CA 1.428 -1.574 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.685 177.165 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.448 ' HG3' ' O ' ' A' ' 38' ' ' PHE . 7.2 mtmp? -51.37 -47.78 62.71 Favored 'General case' 0 C--N 1.369 1.424 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 175.222 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.438 ' HG2' ' OD1' ' A' ' 51' ' ' ASP . 63.3 mttm -55.03 -50.42 69.1 Favored 'General case' 0 CA--C 1.499 -1.009 0 O-C-N 124.178 0.924 . . . . 0.0 109.938 177.824 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.512 ' O ' ' HA ' ' A' ' 55' ' ' MET . 5.1 t80 -60.09 -38.99 84.55 Favored 'General case' 0 C--N 1.309 -1.152 0 CA-C-N 114.032 -1.44 . . . . 0.0 113.605 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.621 HG23 ' O ' ' A' ' 41' ' ' TRP . 0.2 OUTLIER -91.2 -30.04 4.8 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.519 0 N-CA-C 114.39 1.255 . . . . 0.0 114.39 -179.516 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . 0.574 ' HA3' ' CB ' ' A' ' 52' ' ' LYS . . . 87.92 34.76 9.62 Favored Glycine 0 N--CA 1.4 -3.742 0 C-N-CA 120.229 -0.986 . . . . 0.0 112.69 -176.334 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.47 ' CD1' ' CZ ' ' A' ' 13' ' ' ARG . 89.9 t80 -60.7 -49.81 76.0 Favored 'General case' 0 CA--C 1.508 -0.672 0 CA-C-O 121.814 0.816 . . . . 0.0 110.257 177.502 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.469 ' CB ' ' HB3' ' A' ' 51' ' ' ASP . 1.5 t0 -81.94 -176.65 6.23 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 114.123 -1.399 . . . . 0.0 110.717 -168.257 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' SER . . . . . 0.416 ' O ' ' HE2' ' A' ' 52' ' ' LYS . 16.9 m -91.68 -42.96 9.88 Favored 'General case' 0 C--N 1.292 -1.927 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.625 -177.333 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.484 ' CE2' ' HB2' ' A' ' 51' ' ' ASP . 64.8 p-90 -101.29 -20.17 15.34 Favored 'General case' 0 N--CA 1.395 -3.187 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 -176.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.484 ' HB2' ' CE2' ' A' ' 50' ' ' TRP . 31.0 t70 -103.37 78.62 1.63 Allowed 'General case' 0 CA--C 1.459 -2.548 0 CA-C-N 114.07 -1.423 . . . . 0.0 109.057 -169.343 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.574 ' CB ' ' HA3' ' A' ' 46' ' ' GLY . 65.5 pttt -169.92 3.55 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.429 0 CA-C-N 113.632 -1.622 . . . . 0.0 114.829 -174.322 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -64.6 -9.59 20.46 Favored 'General case' 0 C--N 1.299 -1.598 0 CA-C-O 121.561 0.696 . . . . 0.0 110.898 175.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.413 ' HB2' ' HB3' ' A' ' 43' ' ' LYS . 13.1 mm100 -106.62 19.32 20.66 Favored 'General case' 0 N--CA 1.416 -2.147 0 C-N-CA 124.344 1.058 . . . . 0.0 109.832 -176.319 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' MET . . . . . 0.512 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 48.8 ttm -58.69 109.17 0.75 Allowed 'General case' 0 N--CA 1.424 -1.768 0 CA-C-O 121.444 0.64 . . . . 0.0 111.335 -178.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.91 23.9 75.31 Favored Glycine 0 N--CA 1.439 -1.131 0 CA-C-N 115.177 -0.92 . . . . 0.0 112.195 -178.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -95.04 151.88 18.8 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-O 121.115 0.483 . . . . 0.0 110.786 -175.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -83.69 -21.33 32.4 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.103 -178.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -63.51 -18.86 64.25 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.03 -0.986 . . . . 0.0 111.918 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 12.7 m -115.24 -9.12 12.3 Favored 'Isoleucine or valine' 0 CA--C 1.443 -3.172 0 CA-C-O 118.327 -0.844 . . . . 0.0 112.834 -178.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 1.6 p90 -34.34 100.47 0.19 Allowed Pre-proline 0 CA--C 1.557 1.219 0 O-C-N 126.3 2.25 . . . . 0.0 114.181 -163.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -78.29 102.46 1.57 Allowed 'Trans proline' 0 N--CA 1.425 -2.543 0 C-N-CA 122.797 2.331 . . . . 0.0 109.777 174.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -82.01 -146.87 5.91 Favored Glycine 0 C--N 1.295 -1.715 0 CA-C-N 114.29 -1.323 . . . . 0.0 111.629 177.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.467 ' HA ' ' O ' ' A' ' 104' ' ' TYR . 86.8 Cg_exo -50.23 133.92 36.68 Favored 'Trans proline' 0 C--O 1.238 0.492 0 C-N-CA 123.763 2.975 . . . . 0.0 113.82 178.747 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.416 HD13 ' HB3' ' A' ' 100' ' ' LEU . 45.2 mt -68.53 115.12 6.25 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 CA-C-N 114.764 -1.107 . . . . 0.0 111.437 -176.07 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -110.82 121.24 44.85 Favored 'General case' 0 C--N 1.289 -2.033 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 173.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.442 ' OD1' ' HA ' ' A' ' 33' ' ' VAL . 38.5 m-80 -109.03 18.47 20.6 Favored 'General case' 0 C--N 1.306 -1.3 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.725 -176.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 10.0 t -68.8 -2.7 10.08 Favored 'General case' 0 CA--C 1.552 1.039 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -176.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -83.74 -19.88 60.81 Favored Glycine 0 N--CA 1.441 -1.011 0 N-CA-C 111.607 -0.597 . . . . 0.0 111.607 176.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 64.7 mt -91.09 -25.89 19.4 Favored 'General case' 0 CA--C 1.499 -1.018 0 CA-C-O 121.79 0.805 . . . . 0.0 109.699 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 50.1 mt -71.36 129.48 38.93 Favored 'General case' 0 N--CA 1.421 -1.876 0 CA-C-N 114.087 -1.415 . . . . 0.0 110.892 -173.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 73.2 tttt -66.48 156.25 35.33 Favored 'General case' 0 N--CA 1.402 -2.867 0 CA-C-N 114.483 -1.235 . . . . 0.0 109.824 -178.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -73.12 105.29 4.5 Favored 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 179.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 142.55 -54.59 0.6 Allowed Glycine 0 C--N 1.309 -0.945 0 N-CA-C 111.802 -0.519 . . . . 0.0 111.802 178.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -131.64 143.83 50.59 Favored 'General case' 0 CA--C 1.484 -1.574 0 CA-C-O 120.857 0.361 . . . . 0.0 110.785 178.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -83.57 3.12 33.94 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-O 121.88 0.848 . . . . 0.0 110.567 178.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 20.8 mm-40 -112.41 -3.21 14.53 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-O 122.414 1.102 . . . . 0.0 108.221 178.162 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 68.0 m -100.74 137.45 39.12 Favored 'General case' 0 C--N 1.284 -2.252 0 CA-C-N 113.481 -1.69 . . . . 0.0 109.586 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.417 HD22 HG23 ' A' ' 113' ' ' ILE . 96.6 mt -106.94 153.02 23.16 Favored 'General case' 0 C--N 1.296 -1.718 0 CA-C-O 120.953 0.406 . . . . 0.0 111.402 -178.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -65.14 153.09 41.89 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.28 175.069 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -77.0 -33.84 57.55 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 114.581 1.326 . . . . 0.0 114.581 -169.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 19.5 t-80 -98.35 11.76 37.02 Favored 'General case' 0 C--N 1.298 -1.658 0 CA-C-O 120.696 0.284 . . . . 0.0 111.726 -172.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 83.2 mt -66.36 118.63 10.29 Favored 'General case' 0 C--N 1.307 -1.259 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -176.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.406 HG22 HD11 ' A' ' 87' ' ' LEU . 44.8 mm -92.56 170.43 1.23 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 N-CA-C 106.674 -1.602 . . . . 0.0 106.674 175.398 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.677 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 22.4 t70 -60.62 -130.53 0.0 OUTLIER 'General case' 0 CA--C 1.577 2.011 0 C-N-CA 125.472 1.509 . . . . 0.0 112.403 -177.589 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.685 ' HA ' ' O ' ' A' ' 89' ' ' TYR . 9.6 pt-20 -47.51 -17.39 0.09 Allowed 'General case' 0 N--CA 1.5 2.075 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 -176.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.406 HD11 HG22 ' A' ' 84' ' ' ILE . 11.8 mt -67.65 -54.22 21.43 Favored 'General case' 0 C--N 1.29 -2.005 0 CA-C-N 115.201 -0.909 . . . . 0.0 110.394 176.201 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -101.48 -33.8 9.81 Favored 'General case' 0 CA--C 1.499 -0.989 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.136 -178.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . 0.685 ' O ' ' HA ' ' A' ' 86' ' ' GLU . 4.8 p90 -141.11 -160.61 1.1 Allowed 'General case' 0 C--O 1.183 -2.398 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 -179.188 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.594 ' O ' ' HA ' ' A' ' 32' ' ' LEU . 1.2 mm -141.19 145.43 24.98 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.879 0 N-CA-C 106.908 -1.515 . . . . 0.0 106.908 172.24 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 58.2 mt -116.93 123.9 48.09 Favored 'General case' 0 N--CA 1.42 -1.967 0 CA-C-O 121.784 0.802 . . . . 0.0 111.122 171.035 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.415 HD12 ' HB ' ' A' ' 90' ' ' ILE . 1.0 OUTLIER -137.07 155.38 76.15 Favored Pre-proline 0 C--N 1.289 -2.049 0 CA-C-N 114.171 -1.377 . . . . 0.0 108.526 -175.493 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -61.56 169.24 7.06 Favored 'Trans proline' 0 C--O 1.255 1.338 0 C-N-CA 123.213 2.609 . . . . 0.0 110.786 176.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.452 HG23 ' ND2' ' A' ' 98' ' ' ASN . 32.3 m -47.17 -43.28 21.04 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 123.96 0.788 . . . . 0.0 109.406 173.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.505 ' HB3' ' HE2' ' A' ' 99' ' ' LYS . 9.2 mm-40 -56.28 -51.26 68.81 Favored 'General case' 0 C--O 1.196 -1.73 0 C-N-CA 124.422 1.089 . . . . 0.0 111.079 178.266 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.513 ' O ' HD23 ' A' ' 100' ' ' LEU . . . -50.87 -62.11 5.56 Favored Glycine 0 CA--C 1.497 -1.085 0 O-C-N 124.322 1.014 . . . . 0.0 111.567 -177.6 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 68.5 t-105 -53.5 -50.79 64.65 Favored 'General case' 0 C--N 1.309 -1.152 0 C-N-CA 123.696 0.799 . . . . 0.0 110.905 177.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.452 ' ND2' HG23 ' A' ' 94' ' ' THR . 91.3 m-20 -52.2 -34.57 46.08 Favored 'General case' 0 C--O 1.207 -1.148 0 O-C-N 123.562 0.539 . . . . 0.0 112.118 177.058 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.505 ' HE2' ' HB3' ' A' ' 95' ' ' GLU . 50.8 mttm -75.01 -51.67 13.01 Favored 'General case' 0 N--CA 1.412 -2.358 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.513 HD23 ' O ' ' A' ' 96' ' ' GLY . 0.7 OUTLIER -58.95 -39.79 82.71 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.379 0.609 . . . . 0.0 111.534 -179.041 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.441 ' O ' ' HA ' ' A' ' 105' ' ' THR . 20.5 t -73.51 -31.08 31.63 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.172 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.851 177.559 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 37.5 t -73.91 -35.09 64.6 Favored 'General case' 0 C--N 1.314 -0.972 0 O-C-N 121.535 -0.728 . . . . 0.0 109.036 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' TRP . . . . . 0.659 ' CD1' ' HA ' ' A' ' 6' ' ' ALA . 49.4 m0 -78.24 -50.2 12.33 Favored 'General case' 0 N--CA 1.421 -1.924 0 CA-C-N 114.773 -1.103 . . . . 0.0 112.031 -176.731 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' TYR . . . . . 0.467 ' O ' ' HA ' ' A' ' 64' ' ' PRO . 55.2 m-85 -128.9 10.16 5.92 Favored 'General case' 0 CA--C 1.505 -0.764 0 N-CA-C 114.498 1.296 . . . . 0.0 114.498 -172.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.441 ' HA ' ' O ' ' A' ' 101' ' ' VAL 0.274 7.2 p 56.33 174.63 0.04 OUTLIER 'General case' 0 N--CA 1.418 -2.038 0 N-CA-C 117.025 2.231 . . . . 0.0 117.025 179.164 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.522 ' HG ' ' N ' ' A' ' 107' ' ' MET . 28.6 tp -104.93 161.59 14.07 Favored 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 114.57 -1.196 . . . . 0.0 108.487 -179.12 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.522 ' N ' ' HG ' ' A' ' 106' ' ' LEU . 24.4 tpp -72.19 141.06 49.04 Favored 'General case' 0 N--CA 1.38 -3.967 0 CA-C-O 122.047 0.927 . . . . 0.0 109.241 173.26 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . 0.406 ' HB2' ' HE1' ' A' ' 1' ' ' MET 0.276 6.7 tp10 -74.99 125.87 29.81 Favored 'General case' 1 N--CA 1.346 -5.625 0 CA-C-N 113.504 -1.68 . . . . 0.0 110.181 -174.547 . . . . . . . . 4 3 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 104.22 -6.25 46.31 Favored Glycine 0 N--CA 1.412 -2.959 0 CA-C-N 114.589 -1.187 . . . . 0.0 112.661 177.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -109.34 158.08 18.25 Favored 'General case' 0 CA--C 1.494 -1.207 0 C-N-CA 117.936 -1.505 . . . . 0.0 109.805 177.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -122.39 133.47 24.4 Favored Pre-proline 0 C--N 1.286 -2.187 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -177.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -41.66 133.59 3.73 Favored 'Trans proline' 0 CA--C 1.477 -2.372 0 C-N-CA 124.687 3.591 . . . . 0.0 114.671 -177.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.417 HG23 HD22 ' A' ' 79' ' ' LEU . 3.6 mp -96.34 108.74 21.71 Favored 'Isoleucine or valine' 0 N--CA 1.385 -3.709 0 CA-C-N 113.053 -1.885 . . . . 0.0 107.007 179.437 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -113.72 147.89 37.4 Favored 'General case' 0 C--N 1.283 -2.283 0 CA-C-O 122.072 0.939 . . . . 0.0 113.024 -176.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.471 ' CG ' HD12 ' A' ' 32' ' ' LEU . 3.0 mmp_? -127.02 177.62 6.52 Favored 'General case' 0 CA--C 1.476 -1.867 0 N-CA-C 105.537 -2.023 . . . . 0.0 105.537 174.002 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -134.22 166.75 22.07 Favored 'General case' 0 C--N 1.258 -3.39 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' ' 25' ' ' ARG . 59.8 t -54.15 144.01 5.67 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.222 0 CA-C-O 122.493 1.139 . . . . 0.0 111.386 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 13.8 m -84.7 175.33 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.396 -3.166 0 CA-C-N 113.489 -1.687 . . . . 0.0 113.053 -172.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -62.6 -42.72 99.74 Favored 'General case' 0 N--CA 1.433 -1.322 0 CA-C-N 114.185 -1.371 . . . . 0.0 110.219 179.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 . . . . . 0 C--N 1.311 -1.08 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.039 -178.89 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.7 tmm? . . . . . 0 CA--C 1.508 -0.666 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -137.86 140.35 40.4 Favored 'General case' 0 N--CA 1.431 -1.388 0 CA-C-O 120.986 0.422 . . . . 0.0 110.54 -178.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.424 ' HB2' ' CE1' ' A' ' 104' ' ' TYR . 56.6 mm-40 -95.58 119.48 34.15 Favored 'General case' 0 C--N 1.303 -1.44 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.19 175.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -115.57 6.64 20.56 Favored Glycine 0 C--N 1.307 -1.081 0 N-CA-C 111.241 -0.743 . . . . 0.0 111.241 -179.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -85.74 -106.17 0.72 Allowed Glycine 0 N--CA 1.435 -1.414 0 N-CA-C 110.877 -0.889 . . . . 0.0 110.877 178.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 56.43 -158.3 0.25 Allowed 'General case' 0 C--O 1.245 0.865 0 C-N-CA 123.396 0.678 . . . . 0.0 111.84 176.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.426 ' HB2' ' CG2' ' A' ' 11' ' ' THR . . . -93.74 175.21 6.82 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 175.422 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.6 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 12.5 t70 -68.24 144.3 54.95 Favored 'General case' 0 C--N 1.291 -1.961 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 173.373 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.464 ' O ' ' HG3' ' A' ' 13' ' ' ARG . 3.1 mm? -43.63 -53.12 5.94 Favored 'General case' 0 C--N 1.298 -1.662 0 C-N-CA 125.906 1.682 . . . . 0.0 112.67 177.802 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -67.9 -34.49 76.73 Favored 'General case' 0 C--N 1.276 -2.604 0 CA-C-N 114.61 -1.177 . . . . 0.0 110.293 -177.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.469 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 2.9 m -66.44 -46.66 75.73 Favored 'General case' 0 N--CA 1.384 -3.747 0 CA-C-N 114.99 -1.005 . . . . 0.0 110.522 178.042 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.6 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 71.0 mt-30 -56.1 -53.82 52.46 Favored 'General case' 0 N--CA 1.444 -0.758 0 O-C-N 123.548 0.53 . . . . 0.0 110.577 -177.581 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.464 ' HG3' ' O ' ' A' ' 9' ' ' LEU . 59.2 mtt180 -46.64 -58.57 3.7 Favored 'General case' 0 N--CA 1.487 1.381 0 CA-C-O 122.432 1.11 . . . . 0.0 109.798 177.208 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 54.7 m -66.89 -45.49 77.86 Favored 'General case' 0 C--N 1.295 -1.787 0 CA-C-N 113.068 -1.878 . . . . 0.0 113.306 -170.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -67.82 -32.38 72.89 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.51 -175.188 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.495 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 27.7 mm -82.5 -38.29 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.142 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.274 177.106 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.07 -34.95 72.55 Favored 'General case' 0 CA--C 1.501 -0.941 0 CA-C-O 122.027 0.917 . . . . 0.0 108.73 179.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 2.6 m -64.81 -33.88 77.04 Favored 'General case' 0 N--CA 1.401 -2.912 0 CA-C-N 113.656 -1.611 . . . . 0.0 111.299 177.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.599 ' HB3' ' CG ' ' A' ' 93' ' ' PRO . 89.7 mt -85.94 -12.97 49.12 Favored 'General case' 0 C--N 1.267 -3.003 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -176.454 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 11.6 mt -86.43 -21.63 26.99 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 176.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.75 -4.44 37.06 Favored 'General case' 0 N--CA 1.426 -1.649 0 CA-C-N 114.537 -1.21 . . . . 0.0 111.333 -174.649 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.484 ' OG1' ' HA ' ' A' ' 19' ' ' LEU . 52.8 m -54.59 134.5 46.72 Favored 'General case' 0 N--CA 1.398 -3.075 0 C-N-CA 126.291 1.836 . . . . 0.0 111.351 173.323 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 68.3 m -70.48 132.64 45.87 Favored 'General case' 0 N--CA 1.387 -3.592 0 CA-C-N 113.405 -1.725 . . . . 0.0 111.338 179.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.404 HD21 HG11 ' A' ' 117' ' ' VAL . 1.7 pp -110.68 159.43 17.6 Favored 'General case' 0 N--CA 1.411 -2.408 0 CA-C-N 115.353 -0.84 . . . . 0.0 112.592 179.021 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.68 ' O ' HG12 ' A' ' 117' ' ' VAL . 19.9 mmt180 -105.51 -144.68 0.38 Allowed 'General case' 0 C--N 1.271 -2.821 0 N-CA-C 103.727 -2.694 . . . . 0.0 103.727 177.684 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -128.91 14.93 6.36 Favored 'General case' 0 C--N 1.283 -2.323 0 CA-C-O 122.108 0.956 . . . . 0.0 109.868 166.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -130.89 20.53 4.8 Favored Glycine 0 N--CA 1.429 -1.803 0 CA-C-N 114.149 -1.387 . . . . 0.0 112.474 -179.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 45.0 m-20 -91.03 169.61 10.73 Favored 'General case' 0 CA--C 1.492 -1.258 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 177.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.509 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 85.1 m -118.67 130.68 55.98 Favored 'General case' 0 N--CA 1.409 -2.512 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 175.72 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 33.4 m95 -114.7 155.98 25.63 Favored 'General case' 0 C--N 1.284 -2.277 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 177.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.454 ' HB2' ' HB2' ' A' ' 97' ' ' TRP . 84.9 m-85 -111.25 129.83 55.85 Favored 'General case' 0 C--N 1.264 -3.152 0 CA-C-O 121.04 0.448 . . . . 0.0 110.055 -178.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.823 HD12 ' CG ' ' A' ' 89' ' ' TYR . 26.3 tp -86.84 138.96 31.14 Favored 'General case' 1 N--CA 1.376 -4.17 0 N-CA-C 114.374 1.249 . . . . 0.0 114.374 -174.841 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.502 HG13 ' O ' ' A' ' 34' ' ' ASP . 46.3 t -132.85 154.04 39.02 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.465 0 C-N-CA 126.498 1.919 . . . . 0.0 107.821 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.502 ' O ' HG13 ' A' ' 33' ' ' VAL . 23.0 t70 -71.09 144.11 50.42 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 173.299 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.437 ' HA ' HG13 ' A' ' 90' ' ' ILE . 50.2 p -71.98 -35.65 69.57 Favored 'General case' 0 C--N 1.277 -2.578 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.337 -171.699 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 17.0 mmm180 -80.75 -26.53 37.25 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 120.356 -0.538 . . . . 0.0 109.705 -174.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.479 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 67.1 t90 -65.99 -46.89 76.4 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 107.622 -1.251 . . . . 0.0 107.622 177.348 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.441 ' CG ' HD11 ' A' ' 90' ' ' ILE . 33.8 t80 -65.89 -37.65 86.67 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.329 179.488 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.475 ' HA ' ' HD3' ' A' ' 42' ' ' LYS . 94.6 mttt -67.03 -29.76 69.66 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 176.169 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.479 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 22.2 tp60 -66.78 -45.91 76.97 Favored 'General case' 0 N--CA 1.406 -2.67 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 173.007 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 67.4 t90 -59.83 -41.54 91.55 Favored 'General case' 0 C--O 1.213 -0.828 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.649 176.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.528 ' HG2' ' CD1' ' A' ' 47' ' ' PHE . 15.2 mtpp -56.73 -38.19 72.04 Favored 'General case' 0 N--CA 1.44 -0.947 0 C-N-CA 123.252 0.621 . . . . 0.0 112.298 -179.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.435 ' HD3' ' NE2' ' A' ' 54' ' ' GLN . 44.1 mttp -76.54 -37.95 55.84 Favored 'General case' 0 C--N 1.281 -2.391 0 CA-C-N 116.004 -0.543 . . . . 0.0 112.251 178.589 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.546 ' O ' ' HA ' ' A' ' 55' ' ' MET . 0.0 OUTLIER -69.03 -35.57 76.76 Favored 'General case' 0 N--CA 1.412 -2.343 0 CA-C-N 114.857 -1.065 . . . . 0.0 109.59 -179.746 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.497 ' CG1' ' HB2' ' A' ' 47' ' ' PHE . 2.5 p -89.93 -22.28 6.46 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.654 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -177.223 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . 0.46 ' HA3' ' HB2' ' A' ' 52' ' ' LYS . . . 87.67 28.84 23.01 Favored Glycine 0 N--CA 1.435 -1.41 0 C-N-CA 121.122 -0.561 . . . . 0.0 112.446 -174.269 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.528 ' CD1' ' HG2' ' A' ' 42' ' ' LYS . 32.7 t80 -77.44 -35.67 53.74 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 177.703 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.45 ' HB2' ' O ' ' A' ' 51' ' ' ASP . 26.6 m-20 -76.76 103.48 6.74 Favored 'General case' 0 CA--C 1.491 -1.315 0 N-CA-C 106.061 -1.829 . . . . 0.0 106.061 172.596 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 9.2 m -54.61 -32.18 58.36 Favored 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 -176.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 45.7 p90 -95.5 -9.32 32.82 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.26 -178.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.45 ' O ' ' HB2' ' A' ' 48' ' ' ASP . 17.5 t0 -139.94 83.85 1.94 Allowed 'General case' 0 CA--C 1.487 -1.447 0 CA-C-O 122.398 1.094 . . . . 0.0 109.27 -175.349 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.46 ' HB2' ' HA3' ' A' ' 46' ' ' GLY . 55.4 pttt -145.93 16.31 1.39 Allowed 'General case' 0 N--CA 1.409 -2.504 0 CA-C-N 113.819 -1.537 . . . . 0.0 111.226 -173.828 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 19.9 p90 -69.11 -7.53 36.96 Favored 'General case' 0 C--N 1.285 -2.212 0 CA-C-N 114.589 -1.187 . . . . 0.0 111.115 173.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.435 ' NE2' ' HD3' ' A' ' 43' ' ' LYS . 19.7 mt-30 -102.75 12.0 36.85 Favored 'General case' 0 N--CA 1.41 -2.454 0 CA-C-N 114.591 -1.186 . . . . 0.0 109.679 -178.683 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' MET . . . . . 0.546 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 33.1 ttm -60.49 113.84 2.64 Favored 'General case' 0 N--CA 1.422 -1.835 0 CA-C-O 121.698 0.761 . . . . 0.0 111.898 -179.594 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 74.25 18.87 79.87 Favored Glycine 0 N--CA 1.431 -1.69 0 CA-C-N 114.736 -1.12 . . . . 0.0 111.558 -178.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.475 ' HB3' HG23 ' A' ' 60' ' ' VAL . 4.5 t0 -88.13 145.45 25.92 Favored 'General case' 0 CA--C 1.493 -1.215 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 -177.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.44 ' O ' ' HD1' ' A' ' 61' ' ' TYR . 11.5 pt20 -83.8 -8.66 59.18 Favored 'General case' 0 C--N 1.283 -2.313 0 CA-C-O 122.329 1.062 . . . . 0.0 110.535 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -72.99 -20.42 61.02 Favored 'General case' 0 C--N 1.288 -2.092 0 CA-C-N 114.419 -1.264 . . . . 0.0 111.003 173.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.49 HG21 ' HB2' ' A' ' 44' ' ' TYR . 35.4 m -128.1 7.9 3.07 Favored 'Isoleucine or valine' 0 CA--C 1.478 -1.805 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.375 -175.229 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.471 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 2.8 p90 -63.8 115.73 21.11 Favored Pre-proline 0 C--N 1.299 -1.593 0 O-C-N 124.098 0.874 . . . . 0.0 109.39 179.492 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.471 ' HD3' ' HA ' ' A' ' 61' ' ' TYR . 9.3 Cg_endo -87.19 111.86 0.87 Allowed 'Trans proline' 0 N--CA 1.417 -2.972 0 C-N-CA 122.37 2.046 . . . . 0.0 109.562 178.721 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -67.98 -147.19 0.14 Allowed Glycine 0 C--N 1.287 -2.162 0 CA-C-N 114.94 -1.027 . . . . 0.0 112.69 176.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -57.76 136.49 75.77 Favored 'Trans proline' 0 C--O 1.249 1.065 0 C-N-CA 122.101 1.868 . . . . 0.0 112.315 -177.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.46 HG12 ' CZ2' ' A' ' 37' ' ' TRP . 61.1 mt -62.79 110.17 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.074 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.912 -177.652 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -102.85 118.65 37.3 Favored 'General case' 0 C--N 1.299 -1.617 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.719 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -94.87 17.88 12.9 Favored 'General case' 0 C--N 1.296 -1.721 0 CA-C-N 115.71 -0.677 . . . . 0.0 112.615 179.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 19.4 m -79.67 24.57 0.37 Allowed 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 -176.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -111.94 -21.7 6.24 Favored Glycine 0 CA--C 1.496 -1.104 0 N-CA-C 108.702 -1.759 . . . . 0.0 108.702 175.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.549 ' CD1' ' HB3' ' A' ' 89' ' ' TYR . 0.2 OUTLIER -102.72 -42.36 5.91 Favored 'General case' 0 N--CA 1.423 -1.791 0 CA-C-N 113.006 -1.597 . . . . 0.0 108.376 -173.45 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.41 HD12 ' CA ' ' A' ' 76' ' ' ALA . 91.2 mt -65.91 150.54 48.46 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-N 113.926 -1.488 . . . . 0.0 109.229 174.37 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -74.64 -167.87 0.62 Allowed 'General case' 0 C--N 1.296 -1.758 0 CA-C-O 122.049 0.928 . . . . 0.0 111.471 -176.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -95.97 97.96 10.02 Favored 'General case' 0 C--N 1.287 -2.112 0 CA-C-N 114.963 -1.017 . . . . 0.0 108.402 -177.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 127.01 -70.66 0.5 Allowed Glycine 0 N--CA 1.438 -1.167 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.246 179.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -85.11 128.84 34.81 Favored 'General case' 0 CA--C 1.495 -1.161 0 CA-C-O 120.761 0.315 . . . . 0.0 111.651 -179.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . 0.41 ' CA ' HD12 ' A' ' 71' ' ' LEU . . . -90.92 13.97 15.08 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 122.079 0.942 . . . . 0.0 110.301 179.578 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 20.1 mm-40 -120.45 5.91 10.64 Favored 'General case' 0 C--N 1.282 -2.339 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 53.9 m -119.39 124.29 46.22 Favored 'General case' 0 C--N 1.281 -2.408 0 CA-C-N 114.381 -1.282 . . . . 0.0 112.771 -173.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 82.6 mt -92.05 150.09 21.16 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.438 178.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -71.02 151.84 44.18 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.148 178.091 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -78.03 -23.54 48.16 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.798 -177.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 31.7 m170 -88.32 4.77 44.88 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -175.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.411 ' HB3' ' CE2' ' A' ' 89' ' ' TYR . 98.1 mt -65.71 133.38 50.94 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 114.497 1.295 . . . . 0.0 114.497 -173.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.419 HG22 HD11 ' A' ' 87' ' ' LEU . 43.0 mm -115.13 -178.91 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.086 0 N-CA-C 104.977 -2.231 . . . . 0.0 104.977 172.016 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.563 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 21.7 t70 -71.54 -134.53 0.01 OUTLIER 'General case' 0 CA--C 1.57 1.724 0 CA-C-O 117.515 -1.231 . . . . 0.0 110.564 -178.074 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.66 ' HA ' ' O ' ' A' ' 89' ' ' TYR . 3.0 pp20? -45.53 -19.41 0.05 OUTLIER 'General case' 0 N--CA 1.51 2.543 0 N-CA-C 116.117 1.895 . . . . 0.0 116.117 -174.699 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.419 HD11 HG22 ' A' ' 84' ' ' ILE . 23.4 mt -59.76 -50.44 73.84 Favored 'General case' 0 C--N 1.287 -2.138 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.467 172.64 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -101.53 -50.01 3.86 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-N 114.753 -1.112 . . . . 0.0 111.342 -178.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . 0.823 ' CG ' HD12 ' A' ' 32' ' ' LEU . 0.5 OUTLIER -141.16 -175.7 4.42 Favored 'General case' 0 C--O 1.163 -3.472 0 C-N-CA 122.885 0.474 . . . . 0.0 110.968 -175.04 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.441 HD11 ' CG ' ' A' ' 38' ' ' PHE . 7.1 mt -142.24 145.79 23.31 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.499 0 CA-C-N 118.943 0.792 . . . . 0.0 109.49 173.098 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.528 ' CD2' HD11 ' A' ' 32' ' ' LEU . 62.7 mt -109.72 133.58 52.96 Favored 'General case' 0 N--CA 1.405 -2.715 0 CA-C-N 114.662 -1.154 . . . . 0.0 111.841 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.404 HD23 ' N ' ' A' ' 92' ' ' LEU . 1.4 mm? -123.98 151.16 64.62 Favored Pre-proline 0 C--N 1.282 -2.332 0 CA-C-N 113.557 -1.656 . . . . 0.0 106.947 -177.57 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.599 ' CG ' ' HB3' ' A' ' 19' ' ' LEU . 11.1 Cg_endo -65.9 169.18 13.74 Favored 'Trans proline' 0 N--CA 1.443 -1.478 0 C-N-CA 121.937 1.758 . . . . 0.0 109.122 170.149 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.401 ' HA ' ' CE1' ' A' ' 31' ' ' TYR . 21.7 m -43.98 -48.35 8.66 Favored 'General case' 0 C--N 1.315 -0.917 0 O-C-N 123.518 0.512 . . . . 0.0 111.467 174.571 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -71.74 -34.69 69.73 Favored 'General case' 0 CA--C 1.491 -1.292 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.273 -176.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.509 ' O ' HD23 ' A' ' 100' ' ' LEU . . . -56.87 -62.26 6.56 Favored Glycine 0 N--CA 1.42 -2.389 0 N-CA-C 109.979 -1.248 . . . . 0.0 109.979 178.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.454 ' HB2' ' HB2' ' A' ' 31' ' ' TYR . 59.0 t-105 -50.75 -51.52 49.38 Favored 'General case' 0 N--CA 1.434 -1.227 0 C-N-CA 124.869 1.268 . . . . 0.0 110.215 176.184 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -49.15 -37.49 22.32 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 177.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 60.0 mttm -72.38 -51.67 19.43 Favored 'General case' 0 N--CA 1.416 -2.158 0 CA-C-O 119.434 -0.317 . . . . 0.0 110.386 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.509 HD23 ' O ' ' A' ' 96' ' ' GLY . 0.8 OUTLIER -56.94 -39.41 74.47 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.36 0.6 . . . . 0.0 111.504 179.09 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.485 ' O ' ' HA ' ' A' ' 105' ' ' THR . 53.7 t -72.26 -30.78 36.69 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.838 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.78 177.708 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 6.5 t -82.27 -24.96 34.47 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 121.07 -1.019 . . . . 0.0 108.889 -177.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' TRP . . . . . . . . . . . . . 47.2 m0 -83.64 -45.86 12.98 Favored 'General case' 0 N--CA 1.425 -1.683 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.598 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' TYR . . . . . 0.424 ' CE1' ' HB2' ' A' ' 3' ' ' GLU . 29.0 m-85 -131.42 7.64 4.56 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -175.671 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.485 ' HA ' ' O ' ' A' ' 101' ' ' VAL 0.304 35.2 p 57.77 168.37 0.04 OUTLIER 'General case' 0 N--CA 1.416 -2.139 0 N-CA-C 117.666 2.469 . . . . 0.0 117.666 -179.849 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -91.87 153.8 19.29 Favored 'General case' 0 C--N 1.291 -1.955 0 N-CA-C 105.781 -1.933 . . . . 0.0 105.781 -179.624 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 32.2 tpp -73.69 152.21 40.51 Favored 'General case' 0 N--CA 1.381 -3.913 0 CA-C-O 122.357 1.075 . . . . 0.0 110.887 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -63.6 135.31 56.7 Favored 'General case' 0 N--CA 1.395 -3.219 0 CA-C-N 112.979 -1.919 . . . . 0.0 110.006 179.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 80.25 5.77 89.55 Favored Glycine 0 N--CA 1.408 -3.203 0 CA-C-N 114.406 -1.27 . . . . 0.0 113.011 178.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -111.45 168.49 9.49 Favored 'General case' 0 CA--C 1.482 -1.64 0 CA-C-N 117.799 0.8 . . . . 0.0 110.975 177.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . 0.434 ' O ' HD11 ' A' ' 113' ' ' ILE . 7.5 mt-10 -142.87 144.4 29.31 Favored Pre-proline 0 C--N 1.276 -2.624 0 N-CA-C 106.511 -1.663 . . . . 0.0 106.511 -177.077 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_exo -58.58 122.76 12.19 Favored 'Trans proline' 0 CA--C 1.462 -3.101 0 C-N-CA 122.788 2.325 . . . . 0.0 112.773 -177.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.434 HD11 ' O ' ' A' ' 111' ' ' GLU . 3.2 mp -82.77 107.31 14.45 Favored 'Isoleucine or valine' 0 N--CA 1.383 -3.823 0 CA-C-N 113.248 -1.797 . . . . 0.0 107.052 175.586 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . 0.509 ' HB1' ' CG2' ' A' ' 29' ' ' THR . . . -92.46 124.95 36.87 Favored 'General case' 0 C--N 1.274 -2.7 0 CA-C-O 121.599 0.714 . . . . 0.0 109.44 177.454 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -127.78 124.06 36.75 Favored 'General case' 0 N--CA 1.401 -2.885 0 N-CA-C 105.403 -2.073 . . . . 0.0 105.403 -176.071 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -68.52 174.14 4.41 Favored 'General case' 0 C--N 1.29 -2.008 0 CA-C-O 121.651 0.738 . . . . 0.0 112.097 -177.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.68 HG12 ' O ' ' A' ' 25' ' ' ARG . 35.1 t -67.11 149.35 11.64 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.314 0 N-CA-C 105.633 -1.988 . . . . 0.0 105.633 169.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 27.0 m -66.21 145.36 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.401 -2.88 0 CA-C-O 121.45 0.643 . . . . 0.0 110.637 -178.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -96.2 3.44 53.16 Favored 'General case' 0 C--N 1.279 -2.462 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.041 -175.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.426 -1.662 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 177.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.416 ' SD ' ' HA2' ' A' ' 4' ' ' GLY . 52.0 ttm . . . . . 0 CA--C 1.508 -0.656 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -85.77 98.99 11.05 Favored 'General case' 0 N--CA 1.437 -1.12 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 176.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 70.25 107.0 0.06 Allowed 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 126.037 1.735 . . . . 0.0 111.672 -177.411 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . 0.416 ' HA2' ' SD ' ' A' ' 1' ' ' MET . . . -150.53 37.53 0.9 Allowed Glycine 0 N--CA 1.434 -1.476 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.378 178.243 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 100.53 -117.91 6.02 Favored Glycine 0 N--CA 1.444 -0.784 0 C-N-CA 120.564 -0.827 . . . . 0.0 111.627 178.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.422 ' HA ' ' CD1' ' A' ' 103' ' ' TRP . . . -150.68 171.87 16.46 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-O 121.091 0.472 . . . . 0.0 111.025 179.096 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.441 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . -83.89 176.98 8.51 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.031 -178.89 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.611 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 16.5 t70 -72.84 146.67 46.08 Favored 'General case' 0 CA--C 1.481 -1.695 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 176.609 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -47.88 -48.74 31.23 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 124.65 1.18 . . . . 0.0 112.095 176.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -66.65 -37.58 85.11 Favored 'General case' 0 C--N 1.282 -2.341 0 CA-C-N 113.126 -1.852 . . . . 0.0 109.924 -178.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.441 ' CG2' ' HB1' ' A' ' 7' ' ' ALA . 3.4 m -65.37 -56.73 10.97 Favored 'General case' 0 N--CA 1.387 -3.576 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.548 177.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.611 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 76.5 mt-30 -44.55 -61.34 1.58 Allowed 'General case' 0 CA--C 1.508 -0.671 0 C-N-CA 125.035 1.334 . . . . 0.0 113.193 -173.664 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.46 ' HB3' ' CG2' ' A' ' 45' ' ' VAL . 0.0 OUTLIER -66.4 -35.34 80.07 Favored 'General case' 0 N--CA 1.432 -1.352 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 -174.6 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 33.1 t -77.75 -38.98 45.72 Favored 'General case' 0 C--N 1.28 -2.45 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.776 -178.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -65.62 -39.36 91.4 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 -177.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.568 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 34.8 mm -75.27 -39.64 42.54 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.383 0 CA-C-N 114.955 -1.02 . . . . 0.0 110.475 177.218 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.18 -33.66 72.52 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-O 121.531 0.681 . . . . 0.0 109.568 -178.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.48 ' HA ' ' HE2' ' A' ' 21' ' ' LYS . 1.0 OUTLIER -67.15 -31.33 71.68 Favored 'General case' 0 N--CA 1.407 -2.605 0 CA-C-N 114.25 -1.341 . . . . 0.0 112.153 178.791 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.413 ' HB3' ' HG2' ' A' ' 93' ' ' PRO . 71.3 mt -85.94 -16.97 36.7 Favored 'General case' 0 C--N 1.276 -2.59 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -177.705 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 11.0 mt -86.24 -24.42 26.03 Favored 'General case' 0 CA--C 1.502 -0.888 0 CA-C-O 121.231 0.539 . . . . 0.0 110.42 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.48 ' HE2' ' HA ' ' A' ' 18' ' ' THR . 39.6 pttt -86.74 -16.67 35.67 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.907 -171.57 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.4 m -55.33 137.56 47.45 Favored 'General case' 0 N--CA 1.402 -2.871 0 C-N-CA 125.662 1.585 . . . . 0.0 111.67 173.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.4 m -78.43 168.13 20.26 Favored 'General case' 0 N--CA 1.399 -2.994 0 CA-C-N 114.033 -1.44 . . . . 0.0 108.69 174.197 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.541 HD22 ' CZ2' ' A' ' 30' ' ' TRP 0.303 72.6 mt -74.69 138.47 42.84 Favored 'General case' 0 N--CA 1.397 -3.1 0 N-CA-C 116.321 1.971 . . . . 0.0 116.321 -173.812 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.434 ' HB2' ' HB2' ' A' ' 28' ' ' ASP . 7.4 mmm180 -81.54 -178.37 6.92 Favored 'General case' 0 C--N 1.29 -1.982 0 CA-C-N 111.288 -2.687 . . . . 0.0 107.746 -177.321 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 21.6 pttp -117.3 118.88 33.47 Favored 'General case' 0 C--N 1.292 -1.894 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 176.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 58.98 45.12 95.65 Favored Glycine 0 C--O 1.238 0.381 0 CA-C-O 121.479 0.488 . . . . 0.0 111.906 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.434 ' HB2' ' HB2' ' A' ' 25' ' ' ARG . 2.0 t0 -107.32 175.33 5.53 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 -177.81 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.416 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 31.2 m -119.19 123.41 44.29 Favored 'General case' 0 C--N 1.277 -2.581 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 179.694 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.541 ' CZ2' HD22 ' A' ' 24' ' ' LEU . 60.0 m95 -107.06 145.23 32.63 Favored 'General case' 0 C--N 1.279 -2.457 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 177.348 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.469 ' HB2' ' HB2' ' A' ' 97' ' ' TRP . 76.0 m-85 -109.01 127.58 54.21 Favored 'General case' 0 C--N 1.267 -3.01 0 CA-C-O 121.17 0.51 . . . . 0.0 110.933 -177.424 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.766 HD12 ' CD1' ' A' ' 89' ' ' TYR . 23.7 tp -88.33 134.06 33.91 Favored 'General case' 0 N--CA 1.379 -3.993 0 CA-C-N 114.095 -1.411 . . . . 0.0 114.514 -174.842 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 41.5 t -126.88 143.55 39.96 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.728 0 C-N-CA 126.64 1.976 . . . . 0.0 108.753 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.529 ' OD1' ' HB2' ' A' ' 36' ' ' ARG . 11.0 t70 -67.82 123.37 20.38 Favored 'General case' 0 C--N 1.307 -1.257 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 172.825 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 10.7 t -66.99 -24.26 66.02 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 120.664 0.269 . . . . 0.0 110.955 -172.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.529 ' HB2' ' OD1' ' A' ' 34' ' ' ASP . 13.9 mtm-85 -74.31 -25.23 59.45 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.241 0.544 . . . . 0.0 110.633 -177.159 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 69.5 t90 -72.74 -44.82 61.17 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 107.253 -1.388 . . . . 0.0 107.253 172.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.489 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 34.9 t80 -60.84 -37.84 83.42 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 114.773 -1.103 . . . . 0.0 110.798 178.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.414 ' HA ' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -52.65 -44.14 65.95 Favored 'General case' 0 C--N 1.352 0.714 0 N-CA-C 112.141 0.423 . . . . 0.0 112.141 174.026 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 22.0 tp60 -64.54 -43.39 94.13 Favored 'General case' 0 N--CA 1.423 -1.782 0 C-N-CA 123.127 0.571 . . . . 0.0 109.756 179.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.61 ' O ' HG21 ' A' ' 45' ' ' VAL . 74.0 t90 -60.3 -40.29 90.0 Favored 'General case' 0 N--CA 1.429 -1.513 0 CA-C-N 114.642 -1.163 . . . . 0.0 111.009 179.229 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.489 ' HG3' ' O ' ' A' ' 38' ' ' PHE . 34.0 mtmt -52.08 -46.28 65.14 Favored 'General case' 0 CA--C 1.494 -1.193 0 O-C-N 123.357 0.411 . . . . 0.0 111.955 -179.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 61.6 mttm -69.33 -45.22 69.98 Favored 'General case' 0 CA--C 1.479 -1.75 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.572 -176.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.448 ' O ' ' HA ' ' A' ' 55' ' ' MET . 0.2 OUTLIER -57.96 -33.01 68.4 Favored 'General case' 0 N--CA 1.424 -1.748 0 CA-C-N 115.287 -0.869 . . . . 0.0 112.782 179.487 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.61 HG21 ' O ' ' A' ' 41' ' ' TRP . 3.7 m -95.16 -17.21 7.12 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.194 0 N-CA-C 113.692 0.997 . . . . 0.0 113.692 178.734 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 78.32 39.47 22.55 Favored Glycine 0 C--N 1.302 -1.325 0 N-CA-C 109.139 -1.584 . . . . 0.0 109.139 -172.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.42 ' HB2' HG22 ' A' ' 45' ' ' VAL . 46.6 t80 -74.25 -37.6 63.73 Favored 'General case' 0 N--CA 1.439 -1.012 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 178.27 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -74.23 120.92 20.46 Favored 'General case' 0 CA--C 1.49 -1.343 0 N-CA-C 106.677 -1.601 . . . . 0.0 106.677 174.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' SER . . . . . 0.433 ' HA ' ' HE3' ' A' ' 52' ' ' LYS . 30.5 m -58.65 -31.47 68.18 Favored 'General case' 0 C--N 1.298 -1.66 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -177.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 46.2 p90 -86.21 -15.0 42.26 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.354 -178.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 45.6 t0 -122.8 95.27 4.56 Favored 'General case' 0 CA--C 1.487 -1.476 0 CA-C-O 122.489 1.138 . . . . 0.0 110.871 -174.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.433 ' HE3' ' HA ' ' A' ' 49' ' ' SER . 34.3 mmtp -119.51 5.35 11.1 Favored 'General case' 0 C--N 1.284 -2.244 0 CA-C-N 113.624 -1.625 . . . . 0.0 108.621 -178.119 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 84.1 m-85 -78.54 -27.04 45.85 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.787 -174.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.487 ' HB3' HG13 ' A' ' 60' ' ' VAL . 9.5 mm100 -92.81 -3.11 55.27 Favored 'General case' 0 N--CA 1.404 -2.726 0 CA-C-N 114.746 -1.116 . . . . 0.0 110.683 -176.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' MET . . . . . 0.448 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 45.4 ttm -60.73 115.46 3.67 Favored 'General case' 0 N--CA 1.423 -1.808 0 C-N-CA 122.535 0.334 . . . . 0.0 110.535 -178.315 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.86 16.99 80.29 Favored Glycine 0 N--CA 1.439 -1.143 0 CA-C-N 115.437 -0.802 . . . . 0.0 112.251 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.492 ' HB3' HG23 ' A' ' 60' ' ' VAL . 5.9 t0 -91.74 147.5 22.94 Favored 'General case' 0 CA--C 1.502 -0.876 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 -178.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -83.5 -18.69 37.6 Favored 'General case' 0 C--N 1.295 -1.804 0 CA-C-O 121.909 0.861 . . . . 0.0 108.893 178.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 76.9 m-20 -62.34 -21.32 65.21 Favored 'General case' 0 CA--C 1.504 -0.815 0 CA-C-N 114.654 -1.157 . . . . 0.0 111.705 178.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.492 HG23 ' HB3' ' A' ' 57' ' ' ASP . 27.3 m -122.98 15.0 5.41 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.629 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.944 -176.631 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.417 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 1.1 p90 -55.89 120.14 31.14 Favored Pre-proline 0 C--N 1.292 -1.905 0 O-C-N 124.477 1.11 . . . . 0.0 111.439 -178.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.426 ' HG3' ' HA ' ' A' ' 41' ' ' TRP . 6.9 Cg_endo -91.4 115.03 0.41 Allowed 'Trans proline' 0 N--CA 1.421 -2.759 0 C-N-CA 122.909 2.406 . . . . 0.0 110.377 172.46 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -75.82 -153.85 4.58 Favored Glycine 0 C--N 1.282 -2.447 0 CA-C-N 114.256 -1.338 . . . . 0.0 111.964 175.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.439 ' HA ' ' O ' ' A' ' 104' ' ' TYR . 31.9 Cg_exo -57.35 144.08 92.23 Favored 'Trans proline' 0 C--O 1.244 0.786 0 C-N-CA 122.883 2.389 . . . . 0.0 111.88 -179.121 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 68.4 mt -64.69 118.55 7.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.22 -176.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.418 ' HB2' ' HG3' ' A' ' 107' ' ' MET . 12.6 t70 -106.85 109.46 21.37 Favored 'General case' 0 N--CA 1.436 -1.157 0 O-C-N 123.461 0.475 . . . . 0.0 110.086 179.226 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.416 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 94.9 m-20 -100.9 11.65 39.17 Favored 'General case' 0 C--N 1.297 -1.686 0 CA-C-N 115.384 -0.825 . . . . 0.0 111.644 179.403 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 75.7 m -69.9 -16.86 63.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.019 0.438 . . . . 0.0 111.089 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -72.75 -19.0 79.1 Favored Glycine 0 N--CA 1.44 -1.074 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 175.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.451 ' CD2' ' HB3' ' A' ' 89' ' ' TYR . 74.6 mt -96.06 -35.07 11.5 Favored 'General case' 0 CA--C 1.496 -1.134 0 CA-C-O 121.262 0.553 . . . . 0.0 109.623 177.483 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.465 HD12 ' CA ' ' A' ' 76' ' ' ALA . 87.8 mt -69.81 150.02 47.3 Favored 'General case' 0 N--CA 1.425 -1.691 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.198 -178.821 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 47.1 mtpt -69.9 -169.32 0.25 Allowed 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 -173.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -54.37 -46.53 73.03 Favored 'General case' 0 CA--C 1.496 -1.125 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 -171.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -144.59 14.22 2.01 Favored Glycine 0 C--N 1.269 -3.148 0 C-N-CA 119.45 -1.357 . . . . 0.0 113.431 -178.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -120.67 119.07 31.77 Favored 'General case' 0 CA--C 1.49 -1.346 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 178.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . 0.465 ' CA ' HD12 ' A' ' 71' ' ' LEU . . . -92.37 19.42 7.15 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-O 121.957 0.884 . . . . 0.0 110.207 -179.255 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 16.9 mm-40 -123.42 4.07 9.07 Favored 'General case' 0 C--N 1.281 -2.38 0 N-CA-C 107.598 -1.26 . . . . 0.0 107.598 -178.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.441 ' O ' ' HA ' ' A' ' 71' ' ' LEU . 70.7 m -132.6 131.93 41.97 Favored 'General case' 0 C--N 1.286 -2.153 0 CA-C-N 114.296 -1.32 . . . . 0.0 112.368 -173.166 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 36.7 tp -94.97 143.92 26.09 Favored 'General case' 0 N--CA 1.389 -3.524 0 C-N-CA 125.438 1.495 . . . . 0.0 108.706 -178.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 56.1 mtmt -66.94 158.15 31.52 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 -178.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -69.81 -49.91 48.09 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 114.336 1.236 . . . . 0.0 114.336 -167.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 29.9 m170 -93.48 12.01 26.57 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.439 0.903 . . . . 0.0 113.439 -170.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 16.3 mt -72.69 130.38 40.39 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-O 121.701 0.762 . . . . 0.0 112.555 -174.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.427 HG22 HD11 ' A' ' 87' ' ' LEU . 50.7 mm -101.19 175.13 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.935 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 -179.566 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.576 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 6.3 p-10 -64.59 -141.15 0.0 OUTLIER 'General case' 0 C--O 1.2 -1.538 0 C-N-CA 124.915 1.286 . . . . 0.0 112.158 -177.601 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.55 ' HA ' ' O ' ' A' ' 89' ' ' TYR . 0.0 OUTLIER -40.88 -19.9 0.01 OUTLIER 'General case' 0 N--CA 1.516 2.868 0 N-CA-C 115.804 1.779 . . . . 0.0 115.804 -173.865 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.427 HD11 HG22 ' A' ' 84' ' ' ILE . 15.2 mt -58.4 -53.52 57.41 Favored 'General case' 0 C--N 1.29 -2.017 0 C-N-CA 124.056 0.943 . . . . 0.0 109.88 171.618 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -107.11 -40.57 5.39 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.266 0.555 . . . . 0.0 111.138 -178.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . 0.766 ' CD1' HD12 ' A' ' 32' ' ' LEU . 1.8 p90 -140.31 174.13 10.82 Favored 'General case' 0 C--O 1.159 -3.671 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.832 -175.091 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.424 ' O ' HD13 ' A' ' 32' ' ' LEU . 6.0 mt -138.81 143.83 31.13 Favored 'Isoleucine or valine' 0 CA--C 1.481 -1.709 0 O-C-N 120.899 -1.126 . . . . 0.0 110.811 178.054 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.487 ' CD2' HD11 ' A' ' 32' ' ' LEU . 57.5 mt -106.24 128.11 53.72 Favored 'General case' 0 N--CA 1.404 -2.738 0 CA-C-N 114.183 -1.371 . . . . 0.0 111.838 177.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -115.92 149.75 43.8 Favored Pre-proline 0 C--N 1.272 -2.799 0 CA-C-N 113.064 -1.88 . . . . 0.0 106.236 -178.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.413 ' HG2' ' HB3' ' A' ' 19' ' ' LEU . 38.8 Cg_exo -65.36 169.13 12.97 Favored 'Trans proline' 0 N--CA 1.439 -1.679 0 N-CA-C 107.782 -1.661 . . . . 0.0 107.782 168.071 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 10.4 m -40.38 -47.96 2.64 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 123.928 0.767 . . . . 0.0 110.633 172.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -68.06 -39.8 82.93 Favored 'General case' 0 C--O 1.208 -1.129 0 CA-C-N 114.637 -1.165 . . . . 0.0 112.047 -175.054 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.435 ' O ' ' HB2' ' A' ' 99' ' ' LYS . . . -61.19 -52.89 48.96 Favored Glycine 0 N--CA 1.433 -1.518 0 N-CA-C 110.619 -0.992 . . . . 0.0 110.619 -178.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.469 ' HB2' ' HB2' ' A' ' 31' ' ' TYR . 69.5 t-105 -55.66 -53.33 57.81 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 123.596 0.758 . . . . 0.0 110.273 174.872 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 97.0 m-20 -46.86 -41.47 15.77 Favored 'General case' 0 C--O 1.199 -1.591 0 C-N-CA 123.349 0.66 . . . . 0.0 111.688 176.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.435 ' HB2' ' O ' ' A' ' 96' ' ' GLY . 41.6 mttm -64.46 -53.88 41.34 Favored 'General case' 0 CA--C 1.477 -1.862 0 CA-C-O 121.553 0.692 . . . . 0.0 109.989 -178.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 96' ' ' GLY . 77.8 mt -65.53 -33.42 75.88 Favored 'General case' 0 C--N 1.265 -3.096 0 CA-C-N 114.502 -1.226 . . . . 0.0 112.694 -176.148 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.4 ' O ' ' HA ' ' A' ' 105' ' ' THR . 48.1 t -79.64 -25.81 12.37 Favored 'Isoleucine or valine' 0 N--CA 1.4 -2.956 0 CA-C-O 121.494 0.664 . . . . 0.0 110.864 176.04 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 62.4 m -76.2 -38.04 57.01 Favored 'General case' 0 N--CA 1.419 -1.998 0 O-C-N 121.189 -0.944 . . . . 0.0 109.621 175.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' TRP . . . . . 0.422 ' CD1' ' HA ' ' A' ' 6' ' ' ALA . 28.8 m0 -82.17 -44.13 16.82 Favored 'General case' 0 N--CA 1.435 -1.215 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.424 -177.295 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' TYR . . . . . 0.439 ' O ' ' HA ' ' A' ' 64' ' ' PRO . 36.7 m-85 -119.95 -12.12 9.2 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -172.431 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.4 ' HA ' ' O ' ' A' ' 101' ' ' VAL 0.333 11.7 t 53.63 -174.44 0.03 OUTLIER 'General case' 0 C--O 1.24 0.604 0 C-N-CA 126.501 1.92 . . . . 0.0 114.009 -172.9 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -105.32 148.33 27.16 Favored 'General case' 0 C--N 1.248 -3.848 0 CA-C-N 113.425 -1.716 . . . . 0.0 109.212 -171.694 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.418 ' HG3' ' HB2' ' A' ' 66' ' ' ASP . 68.4 mmm -73.13 156.92 38.16 Favored 'General case' 0 CA--C 1.504 -0.822 0 CA-C-O 120.926 0.393 . . . . 0.0 111.503 175.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -61.17 148.37 40.99 Favored 'General case' 0 C--N 1.31 -1.12 0 C-N-CA 124.55 1.14 . . . . 0.0 112.011 -179.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 78.49 -23.89 2.77 Favored Glycine 0 N--CA 1.432 -1.588 0 CA-C-N 114.535 -1.212 . . . . 0.0 113.551 175.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -85.37 159.39 20.01 Favored 'General case' 0 N--CA 1.426 -1.661 0 CA-C-O 121.672 0.748 . . . . 0.0 111.175 -176.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -134.98 156.03 78.73 Favored Pre-proline 0 C--N 1.273 -2.743 0 N-CA-C 106.303 -1.74 . . . . 0.0 106.303 175.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -58.36 122.44 11.68 Favored 'Trans proline' 0 CA--C 1.469 -2.726 0 C-N-CA 122.431 2.088 . . . . 0.0 111.159 176.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.476 ' HB ' ' HB3' ' A' ' 32' ' ' LEU . 63.0 mt -84.42 106.63 14.8 Favored 'Isoleucine or valine' 0 N--CA 1.381 -3.879 0 CA-C-N 113.028 -1.896 . . . . 0.0 106.933 179.085 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . 0.416 ' HB1' ' CG2' ' A' ' 29' ' ' THR . . . -94.74 125.76 39.61 Favored 'General case' 0 C--N 1.27 -2.883 0 CA-C-O 121.725 0.774 . . . . 0.0 110.377 -179.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 10.1 tpt180 -125.72 115.05 19.47 Favored 'General case' 0 N--CA 1.4 -2.952 0 N-CA-C 105.31 -2.107 . . . . 0.0 105.31 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -73.53 166.19 23.69 Favored 'General case' 0 C--N 1.274 -2.683 0 C-N-CA 120.37 -0.532 . . . . 0.0 111.103 -179.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 87.3 t -50.44 144.88 1.74 Allowed 'Isoleucine or valine' 0 C--O 1.242 0.677 0 O-C-N 124.0 0.813 . . . . 0.0 109.595 178.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 30.4 m -42.37 138.79 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.413 -2.314 0 C-N-CA 126.699 2.0 . . . . 0.0 116.027 -170.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -62.85 -26.95 69.01 Favored 'General case' 0 C--N 1.293 -1.872 0 CA-C-N 112.281 -2.236 . . . . 0.0 110.707 178.055 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 . . . . . 0 C--N 1.298 -1.635 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.124 -178.509 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 mpt? . . . . . 0 N--CA 1.473 0.691 0 CA-C-O 121.214 0.53 . . . . 0.0 110.53 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -149.61 31.96 0.72 Allowed 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -176.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -62.07 107.83 0.94 Allowed 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 114.308 -1.315 . . . . 0.0 112.104 -174.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -147.65 6.53 1.04 Allowed Glycine 0 N--CA 1.44 -1.07 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.169 178.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -152.37 59.52 0.41 Allowed Glycine 0 CA--C 1.482 -1.977 0 N-CA-C 110.844 -0.902 . . . . 0.0 110.844 -179.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.551 ' HA ' ' CD1' ' A' ' 103' ' ' TRP . . . -122.38 144.78 48.81 Favored 'General case' 0 N--CA 1.419 -1.989 0 CA-C-O 121.692 0.758 . . . . 0.0 112.471 -179.631 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.413 ' HB2' ' CG2' ' A' ' 11' ' ' THR . . . -73.13 166.53 22.94 Favored 'General case' 0 C--N 1.305 -1.344 0 CA-C-N 114.024 -1.444 . . . . 0.0 110.806 178.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.687 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 25.0 t70 -70.58 146.27 50.21 Favored 'General case' 0 CA--C 1.465 -2.299 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 174.545 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 28.5 mt -53.79 -43.88 69.67 Favored 'General case' 0 CA--C 1.487 -1.454 0 CA-C-N 119.085 0.857 . . . . 0.0 111.166 -177.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -68.24 -24.19 64.88 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 114.897 -1.047 . . . . 0.0 110.094 -176.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.59 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 5.1 m -78.79 -50.77 10.75 Favored 'General case' 0 N--CA 1.38 -3.931 0 CA-C-N 114.498 -1.228 . . . . 0.0 109.462 175.092 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.687 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 52.0 mt-30 -49.16 -61.12 2.25 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.966 0.906 . . . . 0.0 112.298 -175.42 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -49.05 -43.43 40.79 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-O 121.701 0.763 . . . . 0.0 112.356 177.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.4 m -75.32 -34.6 61.25 Favored 'General case' 0 C--N 1.278 -2.534 0 CA-C-N 114.549 -1.205 . . . . 0.0 112.493 -176.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.5 t0 -77.08 -36.74 55.55 Favored 'General case' 0 C--N 1.3 -1.582 0 C-N-CA 123.786 0.834 . . . . 0.0 109.628 -177.01 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.562 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 27.3 mm -73.12 -33.05 41.13 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.244 0 C-N-CA 123.235 0.614 . . . . 0.0 110.468 177.056 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.34 -36.46 71.19 Favored 'General case' 0 CA--C 1.502 -0.89 0 O-C-N 123.855 0.722 . . . . 0.0 109.092 -178.019 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.48 ' O ' ' HG3' ' A' ' 21' ' ' LYS . 24.7 m -54.15 -57.12 12.32 Favored 'General case' 0 N--CA 1.405 -2.708 0 C-N-CA 125.757 1.623 . . . . 0.0 111.096 177.663 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.474 HD23 ' HB ' ' A' ' 18' ' ' THR . 2.7 mm? -66.81 -18.05 65.19 Favored 'General case' 1 N--CA 1.377 -4.099 0 N-CA-C 114.63 1.345 . . . . 0.0 114.63 -178.213 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.562 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 10.0 mt -84.43 -26.08 28.53 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-O 121.64 0.733 . . . . 0.0 109.442 178.593 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.48 ' HG3' ' O ' ' A' ' 18' ' ' THR . 0.0 OUTLIER -91.86 -7.57 48.95 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-N 114.667 -1.152 . . . . 0.0 110.822 -173.628 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 51.9 m -71.25 139.07 49.91 Favored 'General case' 0 N--CA 1.394 -3.275 0 CA-C-N 113.354 -1.748 . . . . 0.0 111.138 177.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 73.7 m -87.3 132.22 34.0 Favored 'General case' 0 N--CA 1.389 -3.501 0 CA-C-N 113.777 -1.556 . . . . 0.0 109.61 176.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.662 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP . 0.6 OUTLIER -80.21 160.09 25.73 Favored 'General case' 0 C--N 1.296 -1.756 0 N-CA-C 114.21 1.189 . . . . 0.0 114.21 -176.969 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.435 ' HD3' ' N ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -101.74 144.08 30.88 Favored 'General case' 0 C--N 1.295 -1.802 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 177.348 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -54.51 -22.2 12.24 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 116.649 2.092 . . . . 0.0 116.649 -169.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -134.7 33.53 2.47 Favored Glycine 0 C--N 1.293 -1.808 0 N-CA-C 110.409 -1.076 . . . . 0.0 110.409 -179.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -85.54 -177.17 6.36 Favored 'General case' 0 C--N 1.315 -0.933 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.285 -178.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.502 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 85.6 m -129.04 121.67 28.39 Favored 'General case' 0 N--CA 1.438 -1.061 0 CA-C-O 121.375 0.607 . . . . 0.0 110.249 -177.768 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.662 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 15.2 m95 -113.31 148.97 34.62 Favored 'General case' 0 N--CA 1.424 -1.767 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.35 -179.043 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 86.7 m-85 -106.68 142.68 35.94 Favored 'General case' 0 C--N 1.292 -1.922 0 C-N-CA 123.07 0.548 . . . . 0.0 111.385 -175.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.58 ' HA ' ' O ' ' A' ' 90' ' ' ILE . 6.2 mp -93.17 133.18 36.62 Favored 'General case' 0 CA--C 1.496 -1.096 0 CA-C-O 122.184 0.992 . . . . 0.0 113.606 -177.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.431 HG11 ' O ' ' A' ' 34' ' ' ASP . 53.4 t -117.06 142.45 30.89 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.484 0 N-CA-C 104.845 -2.28 . . . . 0.0 104.845 174.046 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.431 ' O ' HG11 ' A' ' 33' ' ' VAL . 4.5 t0 -67.28 127.7 33.65 Favored 'General case' 0 C--N 1.288 -2.078 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 172.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 6.5 t -66.46 -30.16 70.44 Favored 'General case' 0 N--CA 1.423 -1.789 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 -174.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 47.1 mtp85 -71.52 -29.78 65.17 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.149 -176.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.44 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 70.6 t90 -69.6 -46.96 65.09 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 173.824 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.483 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 28.9 t80 -61.53 -41.88 97.99 Favored 'General case' 0 C--O 1.212 -0.886 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.075 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.455 ' HA ' ' HE3' ' A' ' 42' ' ' LYS . 0.1 OUTLIER -55.5 -41.2 72.75 Favored 'General case' 0 N--CA 1.439 -1.004 0 O-C-N 122.007 -0.433 . . . . 0.0 111.855 175.091 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.44 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 21.5 tp60 -65.45 -42.38 92.4 Favored 'General case' 0 N--CA 1.423 -1.81 0 C-N-CA 123.495 0.718 . . . . 0.0 109.698 176.45 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 65.2 t90 -61.1 -39.98 92.01 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.592 177.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' A' ' 38' ' ' PHE . 8.3 mtmp? -56.99 -42.81 80.93 Favored 'General case' 0 CA--C 1.495 -1.17 0 CA-C-N 117.948 0.34 . . . . 0.0 110.991 -179.691 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.438 ' HB3' ' HB2' ' A' ' 54' ' ' GLN . 93.5 mttt -58.63 -52.14 66.95 Favored 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 124.175 0.922 . . . . 0.0 109.283 178.37 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.405 ' HB2' HG21 ' A' ' 60' ' ' VAL . 0.4 OUTLIER -65.55 -41.13 93.34 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-N 114.175 -1.375 . . . . 0.0 112.482 -172.48 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.405 ' CG1' ' HB2' ' A' ' 47' ' ' PHE . 3.7 p -90.47 -12.72 9.44 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.721 0 CA-C-N 116.313 -0.403 . . . . 0.0 112.026 -175.678 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . 0.547 ' HA3' ' CB ' ' A' ' 52' ' ' LYS . . . 64.23 45.32 93.89 Favored Glycine 0 N--CA 1.4 -3.72 0 C-N-CA 121.183 -0.532 . . . . 0.0 112.689 -171.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.405 ' HB2' ' CG1' ' A' ' 45' ' ' VAL . 94.5 t80 -66.44 -52.94 41.11 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 123.607 0.763 . . . . 0.0 112.002 -178.254 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.463 ' OD1' ' HB3' ' A' ' 42' ' ' LYS . 16.5 p-10 -99.08 99.64 10.68 Favored 'General case' 0 C--N 1.289 -2.051 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.923 -176.074 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 8.9 m -49.8 -29.73 8.41 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 125.547 1.539 . . . . 0.0 114.158 -176.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.409 ' CE2' ' HB2' ' A' ' 48' ' ' ASP . 49.1 p90 -72.56 -11.66 60.74 Favored 'General case' 0 C--N 1.322 -0.589 0 O-C-N 122.044 -0.41 . . . . 0.0 111.428 179.377 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.516 ' O ' ' HD2' ' A' ' 52' ' ' LYS . 20.1 t70 -129.26 -94.34 0.42 Allowed 'General case' 0 C--N 1.304 -1.387 0 CA-C-O 118.508 -0.758 . . . . 0.0 109.769 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.547 ' CB ' ' HA3' ' A' ' 46' ' ' GLY . 0.0 OUTLIER 42.8 29.11 0.15 Allowed 'General case' 0 CA--C 1.554 1.12 0 N-CA-C 116.392 1.997 . . . . 0.0 116.392 172.087 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 1.6 p90 -63.82 -5.08 3.77 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 115.407 1.632 . . . . 0.0 115.407 -173.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.438 ' HB2' ' HB3' ' A' ' 43' ' ' LYS . 11.2 mm100 -128.1 23.86 6.03 Favored 'General case' 0 C--N 1.285 -2.213 0 C-N-CA 124.015 0.926 . . . . 0.0 110.651 -171.321 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 50.4 ttm -57.0 108.26 0.49 Allowed 'General case' 0 N--CA 1.437 -1.098 0 C-N-CA 124.052 0.941 . . . . 0.0 110.784 -179.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.27 16.84 73.14 Favored Glycine 0 N--CA 1.434 -1.464 0 CA-C-N 115.855 -0.611 . . . . 0.0 112.299 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.514 ' HB3' HG23 ' A' ' 60' ' ' VAL . 7.6 t0 -86.97 148.56 25.27 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 178.405 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.466 ' O ' ' HD1' ' A' ' 61' ' ' TYR . 28.6 pt20 -85.19 -23.26 28.41 Favored 'General case' 0 C--N 1.292 -1.931 0 CA-C-O 121.493 0.663 . . . . 0.0 111.287 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 -62.04 -18.16 59.73 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-O 121.93 0.871 . . . . 0.0 111.699 -179.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.514 HG23 ' HB3' ' A' ' 57' ' ' ASP . 29.3 m -116.64 8.22 7.22 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.098 0 CA-C-N 115.028 -0.987 . . . . 0.0 112.225 -173.154 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.466 ' HD1' ' O ' ' A' ' 58' ' ' GLN . 2.8 p90 -60.37 116.85 19.62 Favored Pre-proline 0 C--N 1.308 -1.215 0 O-C-N 124.215 0.947 . . . . 0.0 110.681 -179.484 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 61' ' ' TYR . 7.7 Cg_endo -89.94 110.48 0.43 Allowed 'Trans proline' 0 N--CA 1.42 -2.818 0 C-N-CA 122.695 2.264 . . . . 0.0 109.39 175.411 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -69.66 -146.79 0.26 Allowed Glycine 0 C--N 1.291 -1.935 0 CA-C-N 115.03 -0.986 . . . . 0.0 112.879 177.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.654 ' HA ' ' O ' ' A' ' 104' ' ' TYR . 32.8 Cg_exo -55.34 134.47 64.06 Favored 'Trans proline' 0 C--O 1.247 0.94 0 C-N-CA 122.778 2.319 . . . . 0.0 112.2 -177.167 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 78.9 mt -62.29 125.14 18.12 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.039 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.433 -178.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.447 ' HB3' ' SD ' ' A' ' 107' ' ' MET . 7.1 p-10 -108.38 122.37 46.86 Favored 'General case' 0 N--CA 1.407 -2.602 0 CA-C-O 122.247 1.022 . . . . 0.0 109.222 177.797 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.551 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 13.4 m120 -100.52 9.65 42.26 Favored 'General case' 0 C--N 1.279 -2.47 0 N-CA-C 107.189 -1.412 . . . . 0.0 107.189 171.182 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 6.0 m -57.28 -34.25 68.47 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 124.965 1.306 . . . . 0.0 111.12 -178.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -77.91 -13.01 83.86 Favored Glycine 0 N--CA 1.438 -1.171 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.272 178.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 36.6 mt -100.03 -14.77 18.49 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 179.446 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.551 ' HG ' ' O ' ' A' ' 67' ' ' ASN . 99.6 mt -80.43 139.19 36.58 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.863 -178.426 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -80.24 179.81 7.47 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.581 175.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -96.97 88.65 4.58 Favored 'General case' 0 C--N 1.288 -2.068 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -174.23 -56.23 0.05 OUTLIER Glycine 0 N--CA 1.426 -1.992 0 N-CA-C 111.015 -0.834 . . . . 0.0 111.015 -178.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.426 ' OD2' ' HG2' ' A' ' 77' ' ' GLN . 4.5 t70 -141.72 -169.63 2.94 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 107.139 -1.43 . . . . 0.0 107.139 177.331 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . 0.411 ' HA ' HD11 ' A' ' 71' ' ' LEU . . . -110.2 11.83 23.52 Favored 'General case' 0 C--N 1.295 -1.793 0 CA-C-O 121.898 0.856 . . . . 0.0 109.254 177.858 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.426 ' HG2' ' OD2' ' A' ' 75' ' ' ASP . 56.8 mm-40 -118.66 -2.63 10.93 Favored 'General case' 0 C--N 1.299 -1.61 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 179.531 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 24.2 p -90.87 116.89 29.04 Favored 'General case' 0 N--CA 1.424 -1.764 0 CA-C-N 113.854 -1.521 . . . . 0.0 109.729 -177.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 19.1 tp -98.29 138.86 34.93 Favored 'General case' 0 N--CA 1.39 -3.444 0 C-N-CA 124.371 1.068 . . . . 0.0 110.068 -176.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.461 ' HE2' ' O ' ' A' ' 71' ' ' LEU . 68.3 mttm -61.31 139.09 58.23 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.556 0.693 . . . . 0.0 111.26 177.593 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -89.28 -19.51 25.25 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-N 114.722 -1.126 . . . . 0.0 113.918 -168.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 28.5 m170 -86.28 -10.98 53.47 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -175.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 8.2 mp -76.77 139.2 40.32 Favored 'General case' 0 C--N 1.295 -1.768 0 N-CA-C 114.948 1.462 . . . . 0.0 114.948 -172.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.409 HG22 HD11 ' A' ' 84' ' ' ILE . 58.0 mt -101.05 178.06 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.426 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 176.339 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.727 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 12.2 t70 -64.87 -130.72 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.557 0 C-N-CA 124.372 1.069 . . . . 0.0 110.186 -177.295 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -38.43 -24.08 0.01 OUTLIER 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 127.585 2.354 . . . . 0.0 114.792 -179.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 18.6 mt -66.43 -47.5 73.03 Favored 'General case' 0 C--N 1.284 -2.28 0 C-N-CA 123.33 0.652 . . . . 0.0 110.821 177.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -113.63 -34.28 5.58 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.41 -175.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . 0.727 ' CE1' ' HA ' ' A' ' 85' ' ' ASP . 3.7 p90 -142.41 -163.87 1.7 Allowed 'General case' 0 C--O 1.187 -2.227 0 N-CA-C 106.315 -1.735 . . . . 0.0 106.315 -179.433 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.58 ' O ' ' HA ' ' A' ' 32' ' ' LEU . 4.7 mt -147.68 148.2 16.6 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.235 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 171.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.483 HD23 ' CD1' ' A' ' 32' ' ' LEU . 26.6 mt -109.81 126.2 53.54 Favored 'General case' 0 N--CA 1.397 -3.113 0 O-C-N 124.532 1.145 . . . . 0.0 111.476 175.329 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -118.86 149.51 46.74 Favored Pre-proline 0 C--N 1.306 -1.317 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.686 -177.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.469 ' HD2' ' HB3' ' A' ' 19' ' ' LEU . 50.0 Cg_exo -61.71 168.67 8.14 Favored 'Trans proline' 0 C--O 1.257 1.465 0 C-N-CA 122.051 1.834 . . . . 0.0 108.51 164.626 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 19.5 m -46.79 -41.01 14.74 Favored 'General case' 0 C--N 1.306 -1.321 0 O-C-N 123.607 0.567 . . . . 0.0 111.05 174.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 5.8 mp0 -61.96 -52.7 62.95 Favored 'General case' 0 CA--C 1.5 -0.95 0 C-N-CA 124.538 1.135 . . . . 0.0 111.046 -178.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.468 ' O ' ' HB2' ' A' ' 99' ' ' LYS . . . -56.07 -54.28 36.6 Favored Glycine 0 N--CA 1.429 -1.795 0 O-C-N 124.015 0.822 . . . . 0.0 111.848 -176.456 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 70.9 t-105 -55.65 -51.09 68.38 Favored 'General case' 0 N--CA 1.425 -1.724 0 C-N-CA 123.007 0.523 . . . . 0.0 111.312 176.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 -52.37 -34.97 50.21 Favored 'General case' 0 CA--C 1.485 -1.533 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 177.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.468 ' HB2' ' O ' ' A' ' 96' ' ' GLY . 54.2 mttm -67.01 -52.11 46.51 Favored 'General case' 0 CA--C 1.468 -2.21 0 CA-C-O 121.375 0.607 . . . . 0.0 110.419 178.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' A' ' 96' ' ' GLY . 69.1 mt -65.99 -35.92 81.89 Favored 'General case' 0 C--N 1.261 -3.25 0 CA-C-N 114.752 -1.113 . . . . 0.0 111.945 -175.683 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.445 ' O ' ' HA ' ' A' ' 105' ' ' THR . 18.6 t -77.59 -25.41 14.8 Favored 'Isoleucine or valine' 0 N--CA 1.399 -2.995 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.723 174.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 38.2 t -74.46 -38.22 63.02 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 176.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' TRP . . . . . 0.56 ' CZ3' ' HB3' ' A' ' 12' ' ' GLN . 36.7 m0 -77.85 -54.56 6.18 Favored 'General case' 0 N--CA 1.422 -1.834 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.201 -176.022 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' TYR . . . . . 0.654 ' O ' ' HA ' ' A' ' 64' ' ' PRO . 30.9 m-85 -127.88 13.21 6.82 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 114.255 1.206 . . . . 0.0 114.255 -175.505 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.445 ' HA ' ' O ' ' A' ' 101' ' ' VAL 0.252 10.0 t 47.28 -170.05 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 126.256 1.822 . . . . 0.0 115.473 178.755 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 52.6 tp -115.39 142.15 47.08 Favored 'General case' 0 C--N 1.26 -3.309 0 CA-C-N 113.29 -1.777 . . . . 0.0 109.006 -175.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.447 ' SD ' ' HB3' ' A' ' 66' ' ' ASP . 72.9 mtp -63.18 156.37 25.44 Favored 'General case' 0 CA--C 1.508 -0.656 0 CA-C-O 122.155 0.979 . . . . 0.0 113.621 178.6 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -71.53 147.66 47.5 Favored 'General case' 0 N--CA 1.413 -2.32 0 CA-C-N 113.967 -1.469 . . . . 0.0 111.533 178.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 94.76 -24.48 27.93 Favored Glycine 0 N--CA 1.418 -2.545 0 CA-C-N 114.926 -1.034 . . . . 0.0 113.504 175.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -113.65 169.86 8.67 Favored 'General case' 0 N--CA 1.421 -1.914 0 CA-C-O 120.698 0.285 . . . . 0.0 110.501 -177.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 65.8 mm-40 -137.1 155.57 76.01 Favored Pre-proline 0 C--N 1.301 -1.503 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 -177.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_exo -56.62 124.57 16.57 Favored 'Trans proline' 0 CA--C 1.463 -3.047 0 C-N-CA 123.498 2.798 . . . . 0.0 113.012 -177.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 2.6 mp -83.36 110.21 17.96 Favored 'Isoleucine or valine' 0 N--CA 1.384 -3.755 0 N-CA-C 106.534 -1.654 . . . . 0.0 106.534 175.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . 0.502 ' HB1' ' CG2' ' A' ' 29' ' ' THR . . . -107.13 132.85 52.56 Favored 'General case' 0 C--N 1.281 -2.387 0 CA-C-N 115.426 -0.806 . . . . 0.0 108.901 178.515 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.432 ' HB2' HD13 ' A' ' 32' ' ' LEU . 5.4 tpt180 -130.33 135.24 47.85 Favored 'General case' 0 N--CA 1.407 -2.616 0 N-CA-C 105.706 -1.961 . . . . 0.0 105.706 -178.505 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -84.23 168.58 15.6 Favored 'General case' 0 C--N 1.272 -2.792 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -175.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.429 HG22 ' O ' ' A' ' 25' ' ' ARG . 90.4 t -69.38 148.04 11.67 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.967 0 CA-C-O 122.376 1.084 . . . . 0.0 111.177 -177.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 15.3 m -76.81 -176.05 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.276 -2.589 0 CA-C-N 113.016 -1.902 . . . . 0.0 113.229 -173.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.403 ' H ' ' CD ' ' A' ' 119' ' ' GLU . 0.1 OUTLIER -93.95 -15.56 24.81 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-N 114.703 -1.135 . . . . 0.0 111.665 -176.757 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 27.8 pt20 . . . . . 0 C--N 1.321 -0.651 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 177.125 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.242 0.673 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -161.69 122.39 2.68 Favored 'General case' 0 N--CA 1.441 -0.889 0 N-CA-C 108.825 -0.805 . . . . 0.0 108.825 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -73.5 111.14 8.36 Favored 'General case' 0 N--CA 1.421 -1.894 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 178.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -120.32 -0.41 12.7 Favored Glycine 0 N--CA 1.441 -1.023 0 CA-C-N 115.799 -0.637 . . . . 0.0 112.419 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -89.01 -40.46 6.17 Favored Glycine 0 CA--C 1.492 -1.345 0 N-CA-C 108.009 -2.036 . . . . 0.0 108.009 178.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -104.32 -176.41 3.07 Favored 'General case' 0 N--CA 1.42 -1.926 0 N-CA-C 105.868 -1.901 . . . . 0.0 105.868 171.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.437 ' HB2' ' CG2' ' A' ' 11' ' ' THR . . . -92.8 155.24 17.78 Favored 'General case' 0 C--N 1.285 -2.227 0 C-N-CA 119.708 -0.797 . . . . 0.0 111.213 -179.634 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.61 ' O ' ' HB ' ' A' ' 11' ' ' THR . 19.6 t70 -78.37 157.55 29.04 Favored 'General case' 0 C--O 1.178 -2.7 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 176.327 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.463 ' O ' ' HG3' ' A' ' 13' ' ' ARG . 32.5 mt -59.1 -33.89 71.36 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 118.945 0.793 . . . . 0.0 111.608 -177.065 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -73.13 -30.0 63.3 Favored 'General case' 0 C--N 1.281 -2.396 0 CA-C-N 114.003 -1.453 . . . . 0.0 108.965 -178.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.61 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 56.2 m -78.12 -49.74 13.33 Favored 'General case' 0 N--CA 1.382 -3.837 0 CA-C-N 113.887 -1.506 . . . . 0.0 110.233 177.332 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.533 ' HB3' ' CZ3' ' A' ' 103' ' ' TRP . 25.7 mt-30 -55.42 -57.29 12.47 Favored 'General case' 0 C--N 1.346 0.443 0 C-N-CA 123.171 0.588 . . . . 0.0 112.132 -172.243 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.463 ' HG3' ' O ' ' A' ' 9' ' ' LEU . 42.4 mtm-85 -44.64 -54.28 6.32 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-O 121.698 0.761 . . . . 0.0 109.896 177.657 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 59.7 m -65.63 -48.92 70.59 Favored 'General case' 0 N--CA 1.419 -2.004 0 CA-C-N 113.467 -1.697 . . . . 0.0 112.732 -172.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -66.54 -35.27 79.82 Favored 'General case' 0 C--N 1.314 -0.977 0 C-N-CA 124.169 0.988 . . . . 0.0 109.841 -175.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 30.4 mm -77.67 -44.53 29.17 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.303 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.769 176.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.15 -35.87 67.65 Favored 'General case' 0 CA--C 1.493 -1.239 0 CA-C-O 121.349 0.595 . . . . 0.0 109.558 -176.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 3.0 m -54.87 -42.77 72.47 Favored 'General case' 0 N--CA 1.394 -3.266 0 C-N-CA 126.017 1.727 . . . . 0.0 112.069 177.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 64.4 mt -83.7 -23.48 31.67 Favored 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -171.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.92 -26.46 68.32 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 122.046 0.927 . . . . 0.0 109.999 170.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -91.22 -36.15 14.1 Favored 'General case' 0 C--N 1.29 -1.984 0 CA-C-N 114.081 -1.418 . . . . 0.0 110.633 -173.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 93.5 m -47.35 139.32 6.57 Favored 'General case' 0 N--CA 1.409 -2.515 0 C-N-CA 125.086 1.354 . . . . 0.0 111.697 173.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.2 t -90.57 166.27 13.3 Favored 'General case' 0 N--CA 1.41 -2.444 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.001 -172.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.535 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP . 0.5 OUTLIER -119.23 166.43 12.99 Favored 'General case' 0 N--CA 1.413 -2.297 0 CA-C-N 115.018 -0.992 . . . . 0.0 113.443 -179.105 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.455 ' O ' HG23 ' A' ' 117' ' ' VAL . 32.7 mmm180 -139.07 138.72 37.36 Favored 'General case' 0 CA--C 1.489 -1.399 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 179.354 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -62.22 109.65 1.38 Allowed 'General case' 0 C--N 1.301 -1.513 0 CA-C-O 121.994 0.902 . . . . 0.0 113.227 -177.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 128.44 -16.86 5.92 Favored Glycine 0 N--CA 1.423 -2.177 0 CA-C-N 113.854 -1.521 . . . . 0.0 110.01 -174.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 39.2 t0 -73.16 155.58 39.48 Favored 'General case' 0 CA--C 1.502 -0.897 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 18.6 m -115.83 123.88 49.28 Favored 'General case' 0 C--N 1.28 -2.456 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 -177.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.535 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 15.9 m95 -112.97 162.36 15.95 Favored 'General case' 0 C--N 1.285 -2.198 0 N-CA-C 107.707 -1.22 . . . . 0.0 107.707 178.708 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.465 ' CD1' ' HA ' ' A' ' 94' ' ' THR . 52.2 m-85 -117.56 141.93 47.78 Favored 'General case' 0 C--N 1.274 -2.694 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.661 ' HA ' ' O ' ' A' ' 90' ' ' ILE 0.414 0.4 OUTLIER -106.36 132.05 52.85 Favored 'General case' 0 N--CA 1.424 -1.741 0 N-CA-C 114.385 1.254 . . . . 0.0 114.385 179.525 . . . . . . . . 4 4 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.428 HG11 ' O ' ' A' ' 34' ' ' ASP . 89.9 t -110.49 151.21 12.74 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.485 0 CA-C-N 112.403 -2.18 . . . . 0.0 106.4 -176.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.504 ' OD1' ' HG2' ' A' ' 36' ' ' ARG . 18.7 t0 -72.91 131.69 42.53 Favored 'General case' 0 C--N 1.296 -1.723 0 N-CA-C 106.895 -1.521 . . . . 0.0 106.895 171.411 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.4 t -71.94 -22.7 61.43 Favored 'General case' 0 N--CA 1.422 -1.864 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 -171.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.504 ' HG2' ' OD1' ' A' ' 34' ' ' ASP . 9.3 mmt-85 -70.49 -36.91 74.08 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.413 -177.346 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.411 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 71.5 t90 -70.94 -43.19 68.67 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 178.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.506 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 41.3 t80 -61.29 -41.83 97.63 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.096 179.024 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.457 ' O ' ' HG3' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -53.03 -45.58 68.06 Favored 'General case' 0 N--CA 1.425 -1.682 0 C-N-CA 122.426 0.29 . . . . 0.0 111.183 174.106 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.411 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 25.5 tp60 -64.09 -39.49 94.17 Favored 'General case' 0 N--CA 1.426 -1.661 0 C-N-CA 124.059 0.944 . . . . 0.0 110.74 179.039 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 65.6 t90 -61.35 -38.08 85.67 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.847 176.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.506 ' HG3' ' O ' ' A' ' 38' ' ' PHE . 33.1 mtmt -59.15 -41.06 87.45 Favored 'General case' 0 CA--C 1.5 -0.971 0 CA-C-O 120.712 0.291 . . . . 0.0 111.268 -179.049 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.529 ' HG2' ' OD2' ' A' ' 51' ' ' ASP . 18.5 mtpp -66.94 -36.58 82.55 Favored 'General case' 0 C--N 1.311 -1.109 0 CA-C-N 115.101 -0.954 . . . . 0.0 108.818 -176.416 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.614 ' O ' ' HA ' ' A' ' 55' ' ' MET . 0.1 OUTLIER -79.37 -36.46 39.22 Favored 'General case' 0 N--CA 1.436 -1.129 0 CA-C-N 114.504 -1.225 . . . . 0.0 111.876 -177.885 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.413 HG11 ' HG2' ' A' ' 13' ' ' ARG . 3.5 p -89.29 -18.63 7.75 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.087 0 O-C-N 121.973 -0.454 . . . . 0.0 111.896 -177.087 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . 0.49 ' HA3' ' HB2' ' A' ' 52' ' ' LYS . . . 81.93 34.11 25.16 Favored Glycine 0 N--CA 1.428 -1.887 0 N-CA-C 111.924 -0.47 . . . . 0.0 111.924 -176.363 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 35.6 t80 -68.86 -42.43 77.08 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 123.055 0.542 . . . . 0.0 110.204 -179.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -86.96 126.43 34.71 Favored 'General case' 0 CA--C 1.498 -1.056 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 177.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.3 m -60.3 -36.26 77.47 Favored 'General case' 0 C--N 1.304 -1.38 0 CA-C-O 121.014 0.435 . . . . 0.0 112.079 -178.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 45.5 p90 -91.36 -7.67 50.2 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.586 -177.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.529 ' OD2' ' HG2' ' A' ' 43' ' ' LYS . 28.7 t70 -136.88 85.44 2.14 Favored 'General case' 0 CA--C 1.485 -1.552 0 CA-C-O 122.014 0.911 . . . . 0.0 110.439 -177.168 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.49 ' HB2' ' HA3' ' A' ' 46' ' ' GLY . 64.3 pttt -160.5 13.05 0.11 Allowed 'General case' 0 N--CA 1.432 -1.362 0 CA-C-N 113.73 -1.577 . . . . 0.0 112.768 -173.561 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 43.2 m-85 -68.64 -3.86 13.43 Favored 'General case' 0 C--N 1.287 -2.125 0 CA-C-O 121.932 0.872 . . . . 0.0 109.254 176.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.406 HE21 ' HE3' ' A' ' 43' ' ' LYS . 0.4 OUTLIER -112.45 17.34 19.38 Favored 'General case' 0 N--CA 1.403 -2.79 0 CA-C-N 114.887 -1.051 . . . . 0.0 109.47 -177.309 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' MET . . . . . 0.614 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 51.6 ttp -62.83 105.11 0.62 Allowed 'General case' 0 N--CA 1.413 -2.289 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.561 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 74.99 29.31 60.94 Favored Glycine 0 N--CA 1.437 -1.269 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.124 -176.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -102.79 154.25 19.36 Favored 'General case' 0 N--CA 1.444 -0.732 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 -177.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 29.7 pt20 -83.27 -17.26 43.2 Favored 'General case' 0 C--N 1.301 -1.525 0 CA-C-O 121.709 0.766 . . . . 0.0 109.986 -177.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 28.0 m-80 -61.18 -24.01 66.0 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 114.784 -1.098 . . . . 0.0 111.959 179.05 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 22.2 m -117.61 -21.4 4.85 Favored 'Isoleucine or valine' 0 CA--C 1.457 -2.633 0 N-CA-C 113.094 0.776 . . . . 0.0 113.094 -176.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . 0.311 2.4 p90 -33.73 102.38 0.21 Allowed Pre-proline 0 CA--C 1.545 0.766 0 O-C-N 126.179 2.174 . . . . 0.0 114.901 -159.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -75.15 102.44 1.59 Allowed 'Trans proline' 0 N--CA 1.426 -2.469 0 C-N-CA 122.9 2.4 . . . . 0.0 110.384 176.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -73.42 -144.12 0.68 Allowed Glycine 0 C--N 1.28 -2.555 0 CA-C-N 114.078 -1.419 . . . . 0.0 112.624 176.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_exo -56.98 133.57 58.82 Favored 'Trans proline' 0 C--O 1.246 0.897 0 C-N-CA 122.926 2.417 . . . . 0.0 112.417 -177.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.504 ' O ' ' HG3' ' A' ' 107' ' ' MET . 54.8 mt -62.16 114.02 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.361 0 CA-C-N 114.966 -1.016 . . . . 0.0 110.47 -177.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.547 ' HB2' ' SD ' ' A' ' 107' ' ' MET . 7.9 t70 -97.98 113.94 25.93 Favored 'General case' 0 CA--C 1.489 -1.381 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 173.463 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.436 ' O ' HD21 ' A' ' 71' ' ' LEU . 13.6 m120 -89.85 -15.06 33.04 Favored 'General case' 0 C--N 1.286 -2.167 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.672 178.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 6.0 m -53.03 -18.2 1.91 Allowed 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 114.995 1.479 . . . . 0.0 114.995 -168.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -76.65 -3.01 77.87 Favored Glycine 0 CA--C 1.527 0.81 0 C-N-CA 120.932 -0.651 . . . . 0.0 113.107 -178.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 39.5 mt -107.44 -17.39 14.13 Favored 'General case' 0 C--O 1.243 0.734 0 CA-C-O 122.253 1.025 . . . . 0.0 109.335 -179.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.436 HD21 ' O ' ' A' ' 67' ' ' ASN . 2.7 mm? -84.01 163.8 19.71 Favored 'General case' 0 N--CA 1.401 -2.918 0 CA-C-N 113.679 -1.6 . . . . 0.0 112.198 -173.22 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.8 mttt -74.37 -176.23 2.61 Favored 'General case' 0 C--N 1.301 -1.51 0 CA-C-N 114.527 -1.215 . . . . 0.0 113.444 -178.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -84.98 35.3 0.57 Allowed 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 115.021 -0.991 . . . . 0.0 112.58 -173.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -166.43 -69.08 0.03 OUTLIER Glycine 0 N--CA 1.428 -1.845 0 C-N-CA 120.184 -1.007 . . . . 0.0 112.878 179.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -86.54 139.23 31.05 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-O 121.406 0.622 . . . . 0.0 111.742 -177.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -87.38 2.8 49.32 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.711 -179.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.614 HE21 ' HA ' ' A' ' 77' ' ' GLN . 0.0 OUTLIER -118.91 -1.2 11.05 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-O 121.809 0.814 . . . . 0.0 109.787 177.591 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 50.5 m -100.66 108.73 20.68 Favored 'General case' 0 C--N 1.281 -2.409 0 CA-C-N 114.407 -1.269 . . . . 0.0 111.137 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 87.1 mt -73.62 153.87 39.99 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.335 -178.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.407 ' HB2' ' CD1' ' A' ' 83' ' ' LEU . 98.9 mttt -78.78 165.83 23.13 Favored 'General case' 0 N--CA 1.426 -1.633 0 C-N-CA 119.734 -0.787 . . . . 0.0 109.202 170.579 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -82.46 -58.87 2.74 Favored 'General case' 0 C--N 1.285 -2.238 0 N-CA-C 113.799 1.037 . . . . 0.0 113.799 -171.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -74.96 12.57 0.83 Allowed 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 116.692 2.108 . . . . 0.0 116.692 -168.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.407 ' CD1' ' HB2' ' A' ' 80' ' ' LYS . 8.1 mp -73.78 169.11 18.04 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-O 121.547 0.689 . . . . 0.0 111.884 176.295 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.431 HG22 HD11 ' A' ' 84' ' ' ILE . 48.3 mt -137.33 166.88 24.19 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.575 0 N-CA-C 105.747 -1.945 . . . . 0.0 105.747 -178.013 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.619 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 65.9 t0 -56.24 -142.56 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.405 0 C-N-CA 126.498 1.919 . . . . 0.0 110.082 178.682 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.489 ' HA ' ' O ' ' A' ' 89' ' ' TYR . 7.5 pt-20 -39.09 -19.03 0.01 OUTLIER 'General case' 0 N--CA 1.533 3.694 0 N-CA-C 116.663 2.097 . . . . 0.0 116.663 -172.737 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.401 ' N ' ' O ' ' A' ' 85' ' ' ASP . 14.5 mt -67.87 -53.95 22.7 Favored 'General case' 0 C--N 1.281 -2.372 0 C-N-CA 123.891 0.876 . . . . 0.0 110.478 175.459 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -108.44 -30.85 8.08 Favored 'General case' 0 C--O 1.216 -0.667 0 CA-C-O 121.4 0.619 . . . . 0.0 110.993 -175.057 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . 0.619 ' CE1' ' HA ' ' A' ' 85' ' ' ASP . 8.7 p90 -142.32 -168.81 2.81 Favored 'General case' 0 C--O 1.173 -2.934 0 N-CA-C 104.738 -2.319 . . . . 0.0 104.738 177.542 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.661 ' O ' ' HA ' ' A' ' 32' ' ' LEU . 2.4 mt -144.7 141.07 23.7 Favored 'Isoleucine or valine' 0 CA--C 1.458 -2.578 0 CA-C-N 121.425 1.92 . . . . 0.0 109.47 173.638 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.428 ' CD2' ' HB3' ' A' ' 32' ' ' LEU . 77.9 mt -107.33 132.03 53.57 Favored 'General case' 0 C--N 1.274 -2.696 0 O-C-N 124.619 1.2 . . . . 0.0 110.792 176.739 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 2.1 mp -141.67 156.65 66.15 Favored Pre-proline 0 C--N 1.276 -2.618 0 N-CA-C 106.8 -1.555 . . . . 0.0 106.8 -177.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -61.23 167.77 8.77 Favored 'Trans proline' 0 C--O 1.26 1.578 0 C-N-CA 122.028 1.819 . . . . 0.0 110.218 174.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.465 ' HA ' ' CD1' ' A' ' 31' ' ' TYR . 32.4 m -49.86 -42.42 47.6 Favored 'General case' 0 C--N 1.306 -1.321 0 O-C-N 123.901 0.751 . . . . 0.0 110.231 176.527 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.499 ' O ' ' HG3' ' A' ' 99' ' ' LYS . 6.3 mm-40 -58.88 -50.34 74.39 Favored 'General case' 0 C--O 1.198 -1.609 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.89 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.548 ' O ' HD23 ' A' ' 100' ' ' LEU . . . -50.45 -58.11 9.49 Favored Glycine 0 CA--C 1.492 -1.362 0 O-C-N 124.153 0.908 . . . . 0.0 111.555 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 66.7 t-105 -54.65 -49.5 70.41 Favored 'General case' 0 C--N 1.311 -1.077 0 C-N-CA 123.169 0.588 . . . . 0.0 110.934 177.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -55.36 -31.11 61.5 Favored 'General case' 0 CA--C 1.496 -1.105 0 C-N-CA 123.088 0.555 . . . . 0.0 112.431 177.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.517 ' HB3' ' CZ2' ' A' ' 103' ' ' TRP . 59.2 mttm -72.82 -51.4 19.04 Favored 'General case' 0 N--CA 1.411 -2.388 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 178.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.548 HD23 ' O ' ' A' ' 96' ' ' GLY . 0.6 OUTLIER -60.7 -39.25 87.83 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.426 0.632 . . . . 0.0 111.153 -179.563 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.478 ' HA ' ' HA ' ' A' ' 105' ' ' THR . 21.3 t -72.89 -28.14 26.32 Favored 'Isoleucine or valine' 0 N--CA 1.403 -2.823 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.774 177.514 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 18.6 t -76.04 -35.45 59.46 Favored 'General case' 0 C--N 1.297 -1.696 0 O-C-N 121.228 -0.92 . . . . 0.0 109.101 178.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' TRP . . . . . 0.533 ' CZ3' ' HB3' ' A' ' 12' ' ' GLN . 28.2 m0 -80.66 -48.44 12.61 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.02 -175.371 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -126.02 -2.14 7.1 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 114.185 1.18 . . . . 0.0 114.185 -177.118 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.478 ' HA ' ' HA ' ' A' ' 101' ' ' VAL 0.351 14.3 t 52.74 175.1 0.02 OUTLIER 'General case' 0 CA--C 1.509 -0.596 0 CA-C-O 123.688 1.708 . . . . 0.0 115.135 -175.59 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 54.4 tp -95.82 160.36 14.51 Favored 'General case' 1 C--N 1.231 -4.553 0 CA-C-N 111.941 -2.39 . . . . 0.0 107.072 -178.023 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.547 ' SD ' ' HB2' ' A' ' 66' ' ' ASP . 37.3 mtp -68.62 155.67 39.58 Favored 'General case' 0 CA--C 1.487 -1.479 0 C-N-CA 119.045 -1.062 . . . . 0.0 108.811 175.311 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -84.43 132.53 34.56 Favored 'General case' 0 C--N 1.258 -3.379 0 CA-C-N 115.446 -0.797 . . . . 0.0 113.059 177.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 111.68 -37.37 3.72 Favored Glycine 0 N--CA 1.397 -3.908 0 CA-C-N 114.068 -1.424 . . . . 0.0 110.875 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -93.38 159.69 15.14 Favored 'General case' 0 N--CA 1.422 -1.857 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 178.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . 0.534 ' HB2' ' OE1' ' A' ' 77' ' ' GLN . 45.3 mt-10 -131.65 154.13 81.73 Favored Pre-proline 0 C--N 1.285 -2.223 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 -177.137 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -54.04 142.43 65.46 Favored 'Trans proline' 0 CA--C 1.458 -3.321 0 C-N-CA 124.13 3.22 . . . . 0.0 114.521 -175.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.51 ' O ' HD22 ' A' ' 32' ' ' LEU . 2.7 mp -100.51 113.8 37.38 Favored 'Isoleucine or valine' 1 N--CA 1.367 -4.604 0 CA-C-N 113.844 -1.526 . . . . 0.0 107.267 175.035 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -100.09 139.51 35.65 Favored 'General case' 0 C--N 1.281 -2.391 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.745 176.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 19.2 tpt180 -134.09 129.3 35.79 Favored 'General case' 0 C--N 1.293 -1.876 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 -177.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -79.58 163.29 24.76 Favored 'General case' 0 C--N 1.28 -2.435 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.677 177.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.455 HG23 ' O ' ' A' ' 25' ' ' ARG . 57.4 t -57.41 153.94 2.36 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.09 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.797 175.521 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 25.0 m -48.68 138.07 4.0 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.405 0 C-N-CA 125.228 1.411 . . . . 0.0 113.688 -176.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -87.77 -7.88 56.74 Favored 'General case' 0 C--N 1.275 -2.657 0 CA-C-N 112.635 -2.075 . . . . 0.0 109.776 -174.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 . . . . . 0 C--N 1.291 -1.955 0 CA-C-N 114.404 -1.271 . . . . 0.0 110.128 175.334 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.6 mmm . . . . . 0 CA--C 1.5 -0.943 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 69.66 147.48 0.07 Allowed 'General case' 0 C--O 1.243 0.744 0 C-N-CA 125.435 1.494 . . . . 0.0 113.401 178.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -87.87 138.64 31.28 Favored 'General case' 0 N--CA 1.416 -2.154 0 N-CA-C 107.322 -1.362 . . . . 0.0 107.322 175.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -166.87 45.99 0.26 Allowed Glycine 0 N--CA 1.437 -1.249 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.548 179.173 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.485 ' O ' ' HA ' ' A' ' 103' ' ' TRP . . . -171.34 23.99 0.09 OUTLIER Glycine 0 C--O 1.224 -0.511 0 C-N-CA 120.203 -0.998 . . . . 0.0 113.314 178.498 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.505 ' HA ' ' CD1' ' A' ' 103' ' ' TRP . . . -121.64 177.37 5.27 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 113.491 0.923 . . . . 0.0 113.491 -175.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.501 ' HB2' ' CG ' ' A' ' 12' ' ' GLN . . . -87.11 -177.13 5.94 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-N 114.336 -1.302 . . . . 0.0 109.489 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.633 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 9.8 t70 -71.32 140.36 50.24 Favored 'General case' 0 N--CA 1.427 -1.582 0 N-CA-C 106.746 -1.575 . . . . 0.0 106.746 173.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 65.0 mt -54.29 -40.79 68.22 Favored 'General case' 0 C--N 1.305 -1.353 0 CA-C-O 121.232 0.539 . . . . 0.0 110.482 -179.112 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -65.12 -39.9 93.74 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 114.318 -1.31 . . . . 0.0 110.033 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.444 ' HB ' ' HB3' ' A' ' 8' ' ' ASP . 2.3 m -66.75 -49.53 65.67 Favored 'General case' 0 N--CA 1.401 -2.877 0 CA-C-N 114.829 -1.078 . . . . 0.0 109.578 179.663 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.633 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 23.9 mt-30 -56.35 -44.87 80.52 Favored 'General case' 0 CA--C 1.474 -1.957 0 CA-C-N 114.914 -1.039 . . . . 0.0 111.225 -179.052 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.704 ' HD3' ' CG2' ' A' ' 45' ' ' VAL 0.268 10.3 mmm180 -69.56 -30.77 68.65 Favored 'General case' 0 N--CA 1.405 -2.685 0 N-CA-C 115.092 1.516 . . . . 0.0 115.092 -177.193 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.8 t -78.92 -46.21 18.89 Favored 'General case' 0 C--N 1.261 -3.279 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 179.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.485 ' O ' ' HB ' ' A' ' 18' ' ' THR . 11.1 t0 -59.83 -48.15 82.86 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 124.016 0.926 . . . . 0.0 109.624 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.581 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 12.4 mm -72.5 -39.07 61.56 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.207 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.611 -177.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.53 ' O ' ' HG2' ' A' ' 21' ' ' LYS . . . -57.94 -35.11 70.66 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 177.657 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.565 ' HA ' ' CE ' ' A' ' 21' ' ' LYS . 1.8 m -64.94 -43.39 92.89 Favored 'General case' 0 N--CA 1.399 -2.986 0 CA-C-N 114.183 -1.372 . . . . 0.0 111.786 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.545 ' HB3' ' CG ' ' A' ' 93' ' ' PRO . 88.8 mt -75.31 -12.87 60.36 Favored 'General case' 0 C--N 1.268 -2.955 0 N-CA-C 113.207 0.817 . . . . 0.0 113.207 -175.891 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.581 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 17.5 mt -86.22 -29.17 23.37 Favored 'General case' 0 C--N 1.309 -1.185 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 176.283 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.565 ' CE ' ' HA ' ' A' ' 18' ' ' THR . 54.4 pttt -96.32 -18.75 19.75 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-N 115.516 -0.766 . . . . 0.0 111.511 -175.186 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.6 m -53.46 131.71 38.61 Favored 'General case' 0 N--CA 1.399 -3.005 0 CA-C-O 122.251 1.024 . . . . 0.0 111.254 170.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 59.5 m -65.67 141.24 58.44 Favored 'General case' 0 N--CA 1.406 -2.634 0 CA-C-N 113.355 -1.748 . . . . 0.0 112.527 -178.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -112.13 159.88 18.09 Favored 'General case' 0 N--CA 1.41 -2.455 0 CA-C-N 114.948 -1.023 . . . . 0.0 112.738 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 28.3 mmt85 -130.86 144.69 51.64 Favored 'General case' 0 C--N 1.288 -2.082 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.365 -177.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 18.0 pttm -66.12 97.03 0.35 Allowed 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 122.213 1.006 . . . . 0.0 109.56 177.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 147.43 -17.44 1.49 Allowed Glycine 0 N--CA 1.427 -1.909 0 CA-C-N 113.636 -1.62 . . . . 0.0 109.965 -172.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -77.42 145.65 37.04 Favored 'General case' 0 CA--C 1.499 -0.986 0 CA-C-O 120.855 0.36 . . . . 0.0 110.113 177.324 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 58.8 m -104.44 132.71 50.38 Favored 'General case' 0 C--N 1.293 -1.877 0 N-CA-C 107.518 -1.289 . . . . 0.0 107.518 176.172 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 22.6 m95 -121.83 143.8 49.2 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 -178.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -107.04 141.03 38.92 Favored 'General case' 0 C--N 1.28 -2.452 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.842 -174.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.533 ' HA ' ' O ' ' A' ' 90' ' ' ILE . 5.9 mp -93.21 135.64 34.22 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 122.048 0.927 . . . . 0.0 112.799 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.47 HG11 ' O ' ' A' ' 34' ' ' ASP . 73.7 t -116.14 136.8 51.94 Favored 'Isoleucine or valine' 0 C--N 1.28 -2.45 0 N-CA-C 105.776 -1.935 . . . . 0.0 105.776 171.478 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.522 ' OD1' ' HG2' ' A' ' 36' ' ' ARG . 19.7 t0 -63.19 126.94 29.06 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 169.008 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.572 ' OG ' ' HE3' ' A' ' 39' ' ' LYS . 48.4 t -67.88 -23.86 65.17 Favored 'General case' 0 C--N 1.287 -2.15 0 CA-C-N 115.311 -0.858 . . . . 0.0 109.831 -171.741 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.522 ' HG2' ' OD1' ' A' ' 34' ' ' ASP . 17.3 mmt-85 -62.24 -40.68 96.98 Favored 'General case' 0 C--O 1.239 0.52 0 N-CA-C 109.603 -0.518 . . . . 0.0 109.603 -178.168 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.45 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 51.4 t90 -68.34 -45.52 72.65 Favored 'General case' 0 C--O 1.227 -0.094 0 CA-C-N 115.304 -0.862 . . . . 0.0 108.784 179.197 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.422 ' CG ' HD11 ' A' ' 90' ' ' ILE . 17.8 t80 -65.65 -34.56 78.51 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.984 -177.06 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.572 ' HE3' ' OG ' ' A' ' 35' ' ' SER . 96.7 mttt -68.51 -32.73 72.89 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-O 120.707 0.289 . . . . 0.0 111.438 176.395 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.45 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 20.1 tp60 -67.66 -41.61 83.5 Favored 'General case' 0 N--CA 1.412 -2.346 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 174.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.462 ' CH2' ' HD2' ' A' ' 13' ' ' ARG . 52.8 t90 -65.67 -40.37 92.33 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 114.902 -1.044 . . . . 0.0 110.121 178.384 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.42 ' HD3' ' HA ' ' A' ' 39' ' ' LYS . 13.4 mtpp -52.06 -43.36 63.78 Favored 'General case' 0 C--O 1.216 -0.697 0 C-N-CA 124.408 1.083 . . . . 0.0 113.398 178.291 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 45.7 mttm -74.7 -40.89 61.07 Favored 'General case' 0 C--N 1.303 -1.422 0 C-N-CA 119.809 -0.756 . . . . 0.0 111.207 179.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.448 ' HB2' HG21 ' A' ' 60' ' ' VAL . 4.2 t80 -55.81 -33.92 64.88 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-N 114.389 -1.278 . . . . 0.0 111.933 179.752 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.704 ' CG2' ' HD3' ' A' ' 13' ' ' ARG . 3.4 m -94.41 -23.54 5.18 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.826 0 N-CA-C 112.608 0.595 . . . . 0.0 112.608 176.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . 0.448 ' CA ' ' HG3' ' A' ' 52' ' ' LYS . . . 81.83 38.82 12.85 Favored Glycine 1 N--CA 1.391 -4.339 0 C-N-CA 120.033 -1.079 . . . . 0.0 110.498 -172.887 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.472 ' CD1' ' CZ ' ' A' ' 13' ' ' ARG . 42.4 t80 -59.66 -49.4 77.89 Favored 'General case' 0 N--CA 1.433 -1.289 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 176.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -73.22 114.47 11.44 Favored 'General case' 0 N--CA 1.429 -1.519 0 CA-C-N 113.651 -1.613 . . . . 0.0 108.263 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 5.7 m -55.56 -27.44 49.09 Favored 'General case' 0 C--N 1.3 -1.571 0 C-N-CA 124.885 1.274 . . . . 0.0 113.206 -175.099 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 44.1 p90 -94.88 -0.91 53.61 Favored 'General case' 0 C--N 1.298 -1.661 0 O-C-N 122.153 -0.342 . . . . 0.0 111.097 -178.135 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -136.34 77.07 1.63 Allowed 'General case' 0 C--N 1.312 -1.028 0 C-N-CA 119.502 -0.879 . . . . 0.0 110.76 -173.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.448 ' HG3' ' CA ' ' A' ' 46' ' ' GLY . 0.0 OUTLIER -118.21 23.09 11.81 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-O 121.809 0.814 . . . . 0.0 111.523 177.029 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 74.4 m-85 -77.87 -22.59 49.56 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 176.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.531 ' HB3' HG12 ' A' ' 60' ' ' VAL . 11.1 mm100 -95.57 -0.68 51.71 Favored 'General case' 0 N--CA 1.419 -2.02 0 C-N-CA 124.733 1.213 . . . . 0.0 110.283 -179.02 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 53.4 ttp -66.18 115.72 6.48 Favored 'General case' 0 N--CA 1.419 -1.994 0 CA-C-O 121.34 0.59 . . . . 0.0 110.672 -176.184 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 79.15 12.73 83.7 Favored Glycine 0 N--CA 1.437 -1.285 0 CA-C-N 115.065 -0.971 . . . . 0.0 111.512 -179.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.522 ' HB3' HG23 ' A' ' 60' ' ' VAL . 5.4 t70 -87.06 146.4 26.1 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 -177.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.449 ' O ' ' HD2' ' A' ' 61' ' ' TYR . 4.6 pt20 -83.82 -21.51 32.07 Favored 'General case' 0 C--N 1.285 -2.211 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.827 -177.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -65.46 -22.86 66.8 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 121.654 0.74 . . . . 0.0 111.859 178.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.531 HG12 ' HB3' ' A' ' 54' ' ' GLN . 32.0 m -116.84 2.66 7.66 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.186 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.449 -173.965 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.449 ' HD2' ' O ' ' A' ' 58' ' ' GLN . 0.3 OUTLIER -68.78 118.32 59.68 Favored Pre-proline 0 C--N 1.313 -1.02 0 C-N-CA 120.115 -0.634 . . . . 0.0 109.969 -179.22 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -92.09 117.74 0.44 Allowed 'Trans proline' 0 N--CA 1.407 -3.563 0 C-N-CA 122.357 2.038 . . . . 0.0 110.455 176.103 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -74.54 -141.17 0.69 Allowed Glycine 0 C--N 1.268 -3.226 0 CA-C-N 114.158 -1.383 . . . . 0.0 111.949 175.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.545 ' HA ' ' O ' ' A' ' 104' ' ' TYR . 50.6 Cg_exo -53.69 131.56 44.65 Favored 'Trans proline' 0 C--O 1.251 1.133 0 C-N-CA 122.881 2.387 . . . . 0.0 113.041 -178.024 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 67.9 mt -60.99 122.76 12.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.381 -178.059 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -117.56 127.54 54.08 Favored 'General case' 0 C--N 1.297 -1.676 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.312 -179.574 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.456 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 93.5 m-20 -112.58 10.69 19.55 Favored 'General case' 0 C--N 1.301 -1.5 0 O-C-N 123.83 0.707 . . . . 0.0 111.104 -178.484 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 50.9 m -88.2 78.43 8.08 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 122.22 1.01 . . . . 0.0 111.621 -177.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 174.02 -37.77 0.12 Allowed Glycine 0 CA--C 1.48 -2.145 0 N-CA-C 104.91 -3.276 . . . . 0.0 104.91 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.441 HD23 ' CA ' ' A' ' 34' ' ' ASP . 28.8 tp -70.18 -45.6 66.37 Favored 'General case' 1 N--CA 1.374 -4.226 0 CA-C-N 112.221 -1.989 . . . . 0.0 107.769 168.866 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.528 ' O ' ' HE3' ' A' ' 80' ' ' LYS . 75.3 mt -71.05 159.75 34.16 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 114.643 -1.162 . . . . 0.0 109.64 175.254 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 41.8 mtpt -74.51 -170.51 1.03 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.776 0.322 . . . . 0.0 111.224 -178.328 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -76.23 96.58 3.95 Favored 'General case' 0 CA--C 1.494 -1.177 0 CA-C-O 121.285 0.564 . . . . 0.0 111.07 -178.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . 0.466 ' C ' ' H ' ' A' ' 76' ' ' ALA . . . 92.08 -175.55 38.24 Favored Glycine 0 N--CA 1.418 -2.501 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.275 179.335 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.404 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 17.1 t0 72.16 -49.49 0.69 Allowed 'General case' 0 N--CA 1.499 2.004 0 C-N-CA 126.395 1.878 . . . . 0.0 113.255 179.05 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . 0.466 ' H ' ' C ' ' A' ' 74' ' ' GLY . . . 62.86 24.02 14.32 Favored 'General case' 0 C--N 1.262 -3.203 0 C-N-CA 127.846 2.458 . . . . 0.0 111.69 -177.616 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.404 ' HG2' ' O ' ' A' ' 75' ' ' ASP . 10.7 mm-40 -130.02 2.78 4.81 Favored 'General case' 0 C--N 1.291 -1.937 0 N-CA-C 105.95 -1.87 . . . . 0.0 105.95 179.553 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.5 p -105.51 123.29 47.64 Favored 'General case' 0 C--N 1.293 -1.874 0 CA-C-N 114.107 -1.406 . . . . 0.0 113.074 -171.119 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 71.5 mt -93.72 138.54 31.82 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-O 120.736 0.303 . . . . 0.0 110.381 175.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.528 ' HE3' ' O ' ' A' ' 71' ' ' LEU . 99.1 mttt -72.35 139.87 48.15 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-O 121.32 0.581 . . . . 0.0 110.753 176.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -65.42 -18.17 65.1 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 122.011 0.91 . . . . 0.0 110.597 176.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 8.8 t-80 -82.82 -7.16 59.68 Favored 'General case' 0 C--N 1.296 -1.728 0 CA-C-N 114.169 -1.378 . . . . 0.0 110.676 -175.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.416 ' HG ' ' HB2' ' A' ' 80' ' ' LYS . 77.2 mt -76.35 130.48 38.14 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-O 121.148 0.499 . . . . 0.0 112.039 -175.613 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.462 HG22 HD11 ' A' ' 84' ' ' ILE . 50.9 mt -112.39 -179.37 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.29 -2.002 0 N-CA-C 105.645 -1.983 . . . . 0.0 105.645 173.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.662 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 13.0 t70 -63.83 -145.14 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.344 0 C-N-CA 124.737 1.215 . . . . 0.0 110.139 -179.342 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.587 ' HA ' ' O ' ' A' ' 89' ' ' TYR 0.254 0.0 OUTLIER -40.63 -17.69 0.01 OUTLIER 'General case' 0 N--CA 1.52 3.036 0 N-CA-C 117.006 2.225 . . . . 0.0 117.006 -175.147 . . . . . . . . 4 4 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.443 HD11 ' CG2' ' A' ' 84' ' ' ILE . 43.4 mt -59.03 -52.48 65.56 Favored 'General case' 0 C--N 1.277 -2.579 0 C-N-CA 123.471 0.708 . . . . 0.0 109.782 170.526 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -112.59 -40.5 4.06 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.987 -176.439 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . 0.662 ' CE1' ' HA ' ' A' ' 85' ' ' ASP . 0.8 OUTLIER -135.74 178.43 7.05 Favored 'General case' 0 C--O 1.17 -3.097 0 C-N-CA 119.84 -0.744 . . . . 0.0 109.606 -179.983 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.533 ' O ' ' HA ' ' A' ' 32' ' ' LEU . 6.8 mt -139.45 147.98 23.81 Favored 'Isoleucine or valine' 0 N--CA 1.404 -2.735 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 174.612 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 64.4 mt -109.72 129.54 55.6 Favored 'General case' 0 N--CA 1.399 -3.015 0 O-C-N 124.623 1.202 . . . . 0.0 111.008 178.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -123.43 150.03 59.74 Favored Pre-proline 0 C--N 1.27 -2.86 0 CA-C-N 113.419 -1.719 . . . . 0.0 106.47 -177.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.545 ' CG ' ' HB3' ' A' ' 19' ' ' LEU . 10.2 Cg_endo -64.95 168.34 13.94 Favored 'Trans proline' 0 N--CA 1.428 -2.332 0 N-CA-C 108.296 -1.463 . . . . 0.0 108.296 169.193 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 18.9 m -43.7 -48.12 7.88 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 123.667 0.604 . . . . 0.0 110.732 173.092 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -68.16 -36.39 79.55 Favored 'General case' 0 CA--C 1.485 -1.553 0 CA-C-N 115.509 -0.769 . . . . 0.0 112.401 -178.365 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -58.88 -57.89 17.45 Favored Glycine 0 N--CA 1.417 -2.632 0 N-CA-C 110.168 -1.173 . . . . 0.0 110.168 179.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.426 ' CE2' ' HB3' ' A' ' 112' ' ' PRO . 70.0 t-105 -54.63 -50.57 67.8 Favored 'General case' 0 N--CA 1.421 -1.893 0 C-N-CA 123.449 0.7 . . . . 0.0 110.611 174.822 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -50.59 -34.48 26.06 Favored 'General case' 0 C--O 1.215 -0.748 0 C-N-CA 123.029 0.532 . . . . 0.0 112.31 177.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.4 ' HE3' ' OD1' ' A' ' 15' ' ' ASP . 41.7 mttm -70.71 -50.02 40.79 Favored 'General case' 0 CA--C 1.456 -2.644 0 CA-C-O 120.862 0.363 . . . . 0.0 110.375 179.447 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.509 HD22 ' CE3' ' A' ' 103' ' ' TRP . 44.3 mt -65.64 -31.2 72.09 Favored 'General case' 0 C--N 1.264 -3.133 0 CA-C-N 115.078 -0.964 . . . . 0.0 111.804 -176.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.455 ' HA ' ' HA ' ' A' ' 105' ' ' THR . 12.7 t -81.06 -24.77 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.402 -2.847 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.319 174.752 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 37.6 t -76.35 -36.44 58.19 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 107.519 -1.289 . . . . 0.0 107.519 177.522 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' TRP . . . . . 0.509 ' CE3' HD22 ' A' ' 100' ' ' LEU . 50.0 m0 -80.9 -53.84 6.1 Favored 'General case' 0 N--CA 1.41 -2.445 0 CA-C-N 114.677 -1.147 . . . . 0.0 112.08 -177.16 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' TYR . . . . . 0.545 ' O ' ' HA ' ' A' ' 64' ' ' PRO . 41.6 m-85 -120.85 -3.38 9.7 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.521 -0.471 . . . . 0.0 112.187 -170.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.455 ' HA ' ' HA ' ' A' ' 101' ' ' VAL 0.265 7.2 t 50.02 -173.46 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.17 0 C-N-CA 126.591 1.956 . . . . 0.0 114.376 -174.132 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 44.9 tp -114.98 144.31 43.8 Favored 'General case' 0 C--N 1.256 -3.483 0 CA-C-N 113.578 -1.646 . . . . 0.0 109.458 -175.347 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.483 ' SD ' ' HB2' ' A' ' 64' ' ' PRO . 65.2 mmm -65.33 156.64 31.47 Favored 'General case' 0 C--O 1.247 0.958 0 CA-C-O 121.584 0.707 . . . . 0.0 110.928 176.682 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -79.83 138.04 37.11 Favored 'General case' 0 C--N 1.278 -2.541 0 CA-C-N 114.77 -1.105 . . . . 0.0 111.951 -176.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 101.63 -37.21 3.75 Favored Glycine 0 N--CA 1.415 -2.762 0 CA-C-N 114.754 -1.112 . . . . 0.0 110.384 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 24.5 mp0 -74.97 158.15 33.76 Favored 'General case' 0 CA--C 1.499 -0.991 0 CA-C-O 121.679 0.752 . . . . 0.0 112.043 178.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -116.83 157.57 45.96 Favored Pre-proline 0 N--CA 1.408 -2.536 0 N-CA-C 105.364 -2.087 . . . . 0.0 105.364 175.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . 0.426 ' HB3' ' CE2' ' A' ' 97' ' ' TRP . 13.8 Cg_exo -73.63 122.32 7.74 Favored 'Trans proline' 0 CA--C 1.451 -3.651 0 N-CA-C 108.047 -1.559 . . . . 0.0 108.047 166.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 3.6 mp -83.01 106.96 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.38 -3.956 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 -179.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . 0.401 ' O ' ' HD3' ' A' ' 115' ' ' ARG . . . -103.5 129.46 50.68 Favored 'General case' 0 N--CA 1.402 -2.841 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.861 -179.141 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.401 ' HD3' ' O ' ' A' ' 114' ' ' ALA . 21.9 mmt180 -131.23 -172.51 2.86 Favored 'General case' 0 C--N 1.286 -2.154 0 N-CA-C 105.475 -2.046 . . . . 0.0 105.475 177.787 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -130.11 176.35 8.16 Favored 'General case' 0 C--N 1.269 -2.911 0 C-N-CA 118.575 -1.25 . . . . 0.0 111.46 -177.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 61.6 t -63.1 141.42 18.15 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.118 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 173.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 25.5 m -82.79 164.42 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.39 -3.454 0 CA-C-O 121.823 0.82 . . . . 0.0 112.463 -173.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -68.0 -12.09 60.12 Favored 'General case' 0 C--N 1.301 -1.52 0 CA-C-N 113.431 -1.713 . . . . 0.0 112.004 -179.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 11.9 mm100 . . . . . 0 C--N 1.309 -1.16 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 -179.254 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.234 0.273 0 N-CA-C 106.526 -1.657 . . . . 0.0 106.526 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -72.32 166.59 22.18 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -172.347 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.408 ' O ' HD22 ' A' ' 9' ' ' LEU . 10.3 mp0 -66.66 120.62 13.77 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 114.328 -1.305 . . . . 0.0 108.893 178.08 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -143.27 -177.01 17.86 Favored Glycine 0 N--CA 1.415 -2.761 0 C-N-CA 120.176 -1.011 . . . . 0.0 112.892 -179.201 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 166.52 103.37 0.17 Allowed Glycine 0 CA--C 1.477 -2.31 0 N-CA-C 106.326 -2.71 . . . . 0.0 106.326 -179.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.495 ' HB2' ' CD1' ' A' ' 103' ' ' TRP . . . 66.24 64.42 0.52 Allowed 'General case' 0 CA--C 1.499 -0.998 0 N-CA-C 105.088 -2.189 . . . . 0.0 105.088 -168.279 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 73.52 155.34 0.16 Allowed 'General case' 0 CA--C 1.499 -0.989 0 CA-C-N 112.138 -2.301 . . . . 0.0 110.207 -172.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.565 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 4.8 p-10 -84.46 153.54 23.29 Favored 'General case' 0 CA--C 1.455 -2.708 0 C-N-CA 118.988 -1.085 . . . . 0.0 109.324 173.598 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.462 ' O ' ' HG3' ' A' ' 13' ' ' ARG . 3.9 mm? -47.5 -46.16 27.01 Favored 'General case' 0 C--N 1.286 -2.19 0 C-N-CA 125.757 1.623 . . . . 0.0 112.1 -178.695 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -67.78 -36.66 80.85 Favored 'General case' 0 C--N 1.257 -3.419 0 CA-C-N 113.064 -1.88 . . . . 0.0 110.273 -177.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.7 m -67.82 -50.21 58.02 Favored 'General case' 0 N--CA 1.395 -3.189 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.393 176.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.565 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 87.8 mt-30 -50.92 -53.4 33.15 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 124.0 0.812 . . . . 0.0 111.387 -175.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.478 ' HG2' HG11 ' A' ' 45' ' ' VAL . 28.9 mtm180 -48.56 -60.04 3.02 Favored 'General case' 0 N--CA 1.487 1.416 0 CA-C-O 122.137 0.97 . . . . 0.0 110.676 176.777 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.9 m -65.26 -43.51 91.08 Favored 'General case' 0 N--CA 1.424 -1.727 0 CA-C-N 113.379 -1.737 . . . . 0.0 113.091 -171.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -68.22 -36.08 78.97 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.451 -176.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.5 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 22.9 mm -78.79 -37.77 20.65 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.158 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.248 177.253 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.2 -43.23 92.24 Favored 'General case' 0 CA--C 1.492 -1.279 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 179.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 2.3 m -55.43 -39.98 70.94 Favored 'General case' 0 N--CA 1.403 -2.775 0 C-N-CA 125.504 1.522 . . . . 0.0 111.543 178.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 78.5 mt -84.29 -13.89 51.25 Favored 'General case' 0 C--N 1.295 -1.799 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -174.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.5 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 59.7 mt -81.58 -17.54 47.97 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 175.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -104.01 -41.44 5.85 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.156 -1.384 . . . . 0.0 111.424 -175.035 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.4 t -46.31 167.29 0.02 OUTLIER 'General case' 0 C--O 1.242 0.702 0 C-N-CA 126.35 1.86 . . . . 0.0 114.81 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 61.5 m -61.25 127.06 29.68 Favored 'General case' 0 N--CA 1.389 -3.502 0 CA-C-N 111.697 -2.501 . . . . 0.0 112.286 179.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.483 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP . 0.3 OUTLIER -111.7 -18.49 12.75 Favored 'General case' 0 C--N 1.283 -2.289 0 CA-C-N 113.797 -1.547 . . . . 0.0 113.116 -177.969 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.612 ' O ' HG12 ' A' ' 117' ' ' VAL . 9.9 mtm180 60.17 -152.67 0.39 Allowed 'General case' 0 C--N 1.253 -3.627 0 CA-C-N 112.838 -1.983 . . . . 0.0 109.09 -178.314 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 57.7 mtmt -126.43 29.02 5.85 Favored 'General case' 0 C--N 1.292 -1.91 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 172.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -153.3 33.33 0.78 Allowed Glycine 0 N--CA 1.435 -1.368 0 CA-C-N 114.33 -1.305 . . . . 0.0 113.074 -179.084 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.415 ' H ' HG21 ' A' ' 117' ' ' VAL . 7.9 t70 -109.56 173.45 6.32 Favored 'General case' 0 N--CA 1.484 1.264 0 N-CA-C 106.954 -1.498 . . . . 0.0 106.954 177.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.412 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 85.9 m -122.19 121.19 36.27 Favored 'General case' 0 C--N 1.282 -2.331 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.483 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 17.4 m95 -103.31 126.74 50.63 Favored 'General case' 0 N--CA 1.388 -3.564 0 CA-C-N 114.662 -1.153 . . . . 0.0 109.388 -179.249 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -98.38 144.47 27.72 Favored 'General case' 0 C--N 1.272 -2.782 0 CA-C-N 115.065 -0.971 . . . . 0.0 110.975 -175.567 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.546 ' HA ' ' O ' ' A' ' 90' ' ' ILE . 6.1 mp -93.5 141.9 27.95 Favored 'General case' 0 N--CA 1.426 -1.665 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.971 -177.254 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.464 ' CG1' ' HB ' ' A' ' 90' ' ' ILE . 0.6 OUTLIER -133.11 142.24 42.62 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.756 0 CA-C-N 114.377 -1.283 . . . . 0.0 108.365 174.963 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.507 ' OD1' ' HB2' ' A' ' 36' ' ' ARG . 10.5 t70 -61.13 128.98 39.08 Favored 'General case' 0 C--N 1.305 -1.349 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 176.205 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.476 ' O ' ' HD3' ' A' ' 39' ' ' LYS . 19.5 p -61.58 -34.86 76.33 Favored 'General case' 0 C--O 1.209 -1.028 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 -173.721 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.507 ' HB2' ' OD1' ' A' ' 34' ' ' ASP . 0.0 OUTLIER -64.13 -36.7 84.88 Favored 'General case' 0 CA--C 1.482 -1.667 0 CA-C-O 121.23 0.538 . . . . 0.0 111.204 -176.564 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.499 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 51.1 t90 -63.32 -44.04 96.08 Favored 'General case' 0 C--N 1.287 -2.131 0 CA-C-N 113.992 -1.458 . . . . 0.0 108.266 178.164 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -69.64 -43.17 73.17 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.829 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.476 ' HD3' ' O ' ' A' ' 35' ' ' SER . 14.6 mptt -55.38 -32.74 62.86 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 122.601 0.361 . . . . 0.0 111.937 171.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.499 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 62.6 tp60 -72.32 -46.62 54.82 Favored 'General case' 0 N--CA 1.419 -2.016 0 C-N-CA 123.22 0.608 . . . . 0.0 109.464 176.727 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 72.6 t90 -58.4 -39.22 79.11 Favored 'General case' 0 C--O 1.213 -0.821 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.871 177.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.508 ' HG2' ' CD1' ' A' ' 47' ' ' PHE . 15.3 mtpp -56.39 -40.0 73.89 Favored 'General case' 0 N--CA 1.44 -0.942 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.417 ' HB3' ' HG3' ' A' ' 54' ' ' GLN . 39.6 mttp -72.31 -44.67 62.37 Favored 'General case' 0 C--N 1.293 -1.87 0 CA-C-O 121.133 0.492 . . . . 0.0 110.25 177.478 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.56 ' O ' ' HA ' ' A' ' 55' ' ' MET . 1.0 OUTLIER -58.12 -39.1 77.83 Favored 'General case' 0 N--CA 1.418 -2.072 0 CA-C-N 114.524 -1.217 . . . . 0.0 110.948 -179.226 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.523 ' CG1' ' HB2' ' A' ' 47' ' ' PHE . 2.6 p -92.25 -23.62 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.387 -3.615 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -175.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . 0.414 ' HA3' ' HG3' ' A' ' 52' ' ' LYS . . . 93.07 22.85 26.54 Favored Glycine 0 N--CA 1.433 -1.535 0 C-N-CA 120.077 -1.059 . . . . 0.0 111.14 -175.249 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.523 ' HB2' ' CG1' ' A' ' 45' ' ' VAL . 20.1 t80 -78.87 -30.81 45.23 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 177.298 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -76.57 111.75 12.39 Favored 'General case' 0 CA--C 1.483 -1.598 0 N-CA-C 106.096 -1.816 . . . . 0.0 106.096 173.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 2.5 p -65.27 -19.72 66.09 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 113.065 0.765 . . . . 0.0 113.065 -175.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 42.1 p90 -97.69 -0.47 45.46 Favored 'General case' 0 C--N 1.286 -2.195 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.446 178.463 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.444 ' OD1' ' HG2' ' A' ' 54' ' ' GLN . 20.4 t0 -141.63 91.9 2.41 Favored 'General case' 0 CA--C 1.491 -1.318 0 C-N-CA 118.738 -1.185 . . . . 0.0 111.208 -176.593 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.44 ' HZ1' ' HB2' ' A' ' 52' ' ' LYS . 0.1 OUTLIER -121.77 18.86 11.07 Favored 'General case' 0 C--N 1.291 -1.939 0 CA-C-O 121.639 0.733 . . . . 0.0 110.541 175.836 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -78.91 -33.36 45.59 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 176.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.466 ' HB3' HG13 ' A' ' 60' ' ' VAL . 10.3 mm100 -81.76 -3.85 54.86 Favored 'General case' 0 N--CA 1.42 -1.973 0 CA-C-N 113.854 -1.521 . . . . 0.0 110.863 -177.139 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' MET . . . . . 0.56 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 46.6 ttm -62.63 114.83 3.8 Favored 'General case' 0 N--CA 1.421 -1.918 0 C-N-CA 123.115 0.566 . . . . 0.0 111.149 -177.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.01 5.66 89.47 Favored Glycine 0 N--CA 1.434 -1.481 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.994 179.301 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -81.38 141.18 34.22 Favored 'General case' 0 CA--C 1.496 -1.122 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 -177.386 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.557 ' O ' ' HD2' ' A' ' 61' ' ' TYR . 11.9 pt20 -78.72 -20.34 50.28 Favored 'General case' 0 C--N 1.277 -2.567 0 CA-C-N 114.926 -1.033 . . . . 0.0 109.332 177.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -58.18 -29.97 66.06 Favored 'General case' 0 CA--C 1.497 -1.082 0 CA-C-O 121.939 0.876 . . . . 0.0 111.064 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.498 HG21 ' HB2' ' A' ' 44' ' ' TYR . 21.7 m -115.29 2.3 8.04 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.998 0 CA-C-N 114.744 -1.116 . . . . 0.0 112.253 -171.297 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.557 ' HD2' ' O ' ' A' ' 58' ' ' GLN . 1.8 p90 -54.51 116.68 11.36 Favored Pre-proline 0 C--N 1.306 -1.307 0 O-C-N 124.373 1.045 . . . . 0.0 111.594 -175.819 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 61' ' ' TYR . 9.0 Cg_endo -87.92 109.17 0.63 Allowed 'Trans proline' 0 N--CA 1.426 -2.469 0 C-N-CA 122.763 2.309 . . . . 0.0 109.833 176.456 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -74.28 -141.19 0.65 Allowed Glycine 0 C--N 1.283 -2.38 0 CA-C-N 114.662 -1.154 . . . . 0.0 113.023 177.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.64 129.16 33.57 Favored 'Trans proline' 0 C--O 1.24 0.584 0 C-N-CA 123.04 2.493 . . . . 0.0 113.346 -176.592 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.438 HD13 ' HB3' ' A' ' 100' ' ' LEU . 47.6 mt -65.55 114.17 2.71 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.067 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.469 -178.719 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -108.36 127.53 53.96 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-O 120.775 0.321 . . . . 0.0 110.502 178.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.458 HD22 ' HA ' ' A' ' 33' ' ' VAL . 15.2 m120 -113.09 6.37 17.56 Favored 'General case' 0 C--N 1.302 -1.487 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.396 -176.693 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 12.1 t -53.8 -32.99 54.63 Favored 'General case' 0 CA--C 1.557 1.233 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 -174.355 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -73.96 -14.79 79.99 Favored Glycine 0 CA--C 1.525 0.691 0 C-N-CA 121.202 -0.523 . . . . 0.0 112.703 -179.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.437 HD11 HD21 ' A' ' 67' ' ' ASN . 61.6 mt -89.67 -15.56 32.37 Favored 'General case' 0 C--O 1.243 0.755 0 CA-C-O 121.949 0.881 . . . . 0.0 109.273 -179.451 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.579 ' HA ' ' HA ' ' A' ' 79' ' ' LEU . 74.9 mt -86.45 161.44 18.63 Favored 'General case' 0 C--N 1.292 -1.929 0 CA-C-N 114.863 -1.062 . . . . 0.0 112.065 -173.005 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt -92.12 -172.65 3.2 Favored 'General case' 0 C--N 1.308 -1.199 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 178.443 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -94.2 106.83 18.8 Favored 'General case' 0 C--N 1.291 -1.97 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 175.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 165.46 -96.12 0.13 Allowed Glycine 0 N--CA 1.433 -1.531 0 N-CA-C 111.383 -0.687 . . . . 0.0 111.383 -177.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -112.04 168.23 9.77 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 179.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -86.99 5.64 36.32 Favored 'General case' 0 C--N 1.305 -1.367 0 CA-C-O 122.135 0.969 . . . . 0.0 110.969 -176.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 -114.82 -1.95 13.07 Favored 'General case' 0 C--N 1.286 -2.18 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 178.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.8 m -93.87 107.01 18.95 Favored 'General case' 0 C--N 1.296 -1.76 0 CA-C-N 114.247 -1.342 . . . . 0.0 108.541 -177.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.579 ' HA ' ' HA ' ' A' ' 71' ' ' LEU . 1.5 pp -107.91 154.76 21.13 Favored 'General case' 0 C--N 1.292 -1.925 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.433 -174.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.485 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 50.3 mtmt -66.27 112.38 3.95 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 122.052 0.929 . . . . 0.0 111.007 179.194 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -60.12 -27.85 67.38 Favored 'General case' 0 C--N 1.298 -1.656 0 C-N-CA 124.979 1.312 . . . . 0.0 112.781 -173.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 33.0 m170 -91.96 11.58 24.62 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 112.43 0.53 . . . . 0.0 112.43 -175.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 80' ' ' LYS . 61.5 mt -77.36 133.95 38.59 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-O 121.007 0.432 . . . . 0.0 111.266 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 42.8 mt -81.0 164.15 3.11 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.179 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 177.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.727 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 5.3 p-10 -64.39 -110.87 0.0 OUTLIER 'General case' 0 C--O 1.19 -2.079 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -176.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -44.11 -29.67 0.65 Allowed 'General case' 0 CA--C 1.557 1.232 0 C-N-CA 127.946 2.498 . . . . 0.0 113.466 -177.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 22.9 mt -72.57 -57.59 4.03 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.283 -178.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -86.55 -29.45 22.65 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.637 -176.044 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . 0.727 ' CE1' ' HA ' ' A' ' 85' ' ' ASP . 7.8 p90 -155.94 -163.06 1.41 Allowed 'General case' 0 C--O 1.194 -1.853 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 -175.386 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.546 ' O ' ' HA ' ' A' ' 32' ' ' LEU . 0.6 OUTLIER -136.74 148.48 26.79 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.085 0 N-CA-C 106.673 -1.603 . . . . 0.0 106.673 167.138 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.486 HD23 ' CD1' ' A' ' 32' ' ' LEU . 15.9 mt -107.33 123.49 48.42 Favored 'General case' 1 N--CA 1.367 -4.612 0 O-C-N 124.55 1.156 . . . . 0.0 109.24 169.688 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 12.0 mt -118.12 146.87 40.25 Favored Pre-proline 0 C--N 1.283 -2.318 0 N-CA-C 106.315 -1.735 . . . . 0.0 106.315 -178.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -71.17 169.56 20.34 Favored 'Trans proline' 0 C--O 1.259 1.574 0 C-N-CA 121.974 1.783 . . . . 0.0 108.109 176.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.583 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 98.6 m -38.96 -52.2 1.79 Allowed 'General case' 0 CA--C 1.543 0.675 0 O-C-N 123.991 0.807 . . . . 0.0 111.707 178.082 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -72.66 -30.95 64.71 Favored 'General case' 0 CA--C 1.498 -1.021 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 -175.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.57 ' O ' HD23 ' A' ' 100' ' ' LEU . . . -62.75 -55.05 29.21 Favored Glycine 0 N--CA 1.43 -1.722 0 N-CA-C 109.158 -1.577 . . . . 0.0 109.158 178.102 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.406 ' CH2' HD11 ' A' ' 106' ' ' LEU . 68.5 t-105 -58.79 -49.82 76.25 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 123.752 0.821 . . . . 0.0 110.047 178.777 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.583 ' HB2' ' O ' ' A' ' 94' ' ' THR . 5.9 t-20 -48.52 -44.33 36.05 Favored 'General case' 0 C--O 1.207 -1.174 0 C-N-CA 124.909 1.283 . . . . 0.0 110.11 179.096 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -66.84 -51.82 51.03 Favored 'General case' 0 N--CA 1.423 -1.797 0 CA-C-O 119.16 -0.447 . . . . 0.0 111.458 178.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.57 HD23 ' O ' ' A' ' 96' ' ' GLY . 0.4 OUTLIER -59.47 -34.51 72.64 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 121.396 0.617 . . . . 0.0 112.071 179.929 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.44 ' HA ' ' HA ' ' A' ' 105' ' ' THR . 24.0 t -78.0 -27.34 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.378 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.969 178.183 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 73.8 m -78.87 -32.08 45.79 Favored 'General case' 0 C--N 1.291 -1.969 0 O-C-N 121.08 -1.013 . . . . 0.0 109.022 176.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' TRP . . . . . 0.495 ' CD1' ' HB2' ' A' ' 6' ' ' ALA . 50.6 m0 -79.88 -49.78 11.43 Favored 'General case' 0 N--CA 1.423 -1.792 0 CA-C-N 115.428 -0.805 . . . . 0.0 112.316 -177.772 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -129.92 5.06 4.96 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -175.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.44 ' HA ' ' HA ' ' A' ' 101' ' ' VAL 0.321 13.6 t 49.63 -176.5 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 123.876 1.798 . . . . 0.0 115.268 -176.926 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.411 HD13 ' O ' ' A' ' 65' ' ' ILE . 37.0 tp -104.56 156.33 18.05 Favored 'General case' 1 C--N 1.23 -4.623 0 CA-C-N 112.022 -2.354 . . . . 0.0 107.251 -175.982 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 32.6 tpp -69.38 132.58 46.6 Favored 'General case' 1 N--CA 1.366 -4.633 0 CA-C-O 122.353 1.073 . . . . 0.0 110.294 178.559 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -63.92 136.87 57.72 Favored 'General case' 0 C--N 1.251 -3.677 0 CA-C-N 112.29 -2.232 . . . . 0.0 111.15 -176.093 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 93.64 -18.04 57.31 Favored Glycine 0 N--CA 1.416 -2.684 0 CA-C-N 114.99 -1.005 . . . . 0.0 112.533 179.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -113.88 127.33 55.94 Favored 'General case' 1 N--CA 1.362 -4.866 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 -179.581 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 -98.36 153.32 38.08 Favored Pre-proline 0 C--N 1.301 -1.536 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 -179.518 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_exo -48.49 129.36 19.66 Favored 'Trans proline' 0 CA--C 1.485 -1.953 0 C-N-CA 124.397 3.398 . . . . 0.0 115.985 -174.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.445 ' N ' HD13 ' A' ' 113' ' ' ILE . 3.1 mp -92.4 108.95 20.83 Favored 'Isoleucine or valine' 0 N--CA 1.384 -3.732 0 CA-C-N 111.796 -2.456 . . . . 0.0 105.764 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . 0.412 ' HB1' ' CG2' ' A' ' 29' ' ' THR . . . -118.6 149.89 40.6 Favored 'General case' 0 C--N 1.292 -1.901 0 N-CA-C 114.02 1.119 . . . . 0.0 114.02 -173.864 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 81.8 mtt180 -135.61 167.1 21.74 Favored 'General case' 0 CA--C 1.47 -2.113 0 C-N-CA 125.873 1.669 . . . . 0.0 107.121 172.181 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -101.33 176.02 5.38 Favored 'General case' 0 C--N 1.262 -3.234 0 C-N-CA 118.536 -1.266 . . . . 0.0 110.902 179.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.612 HG12 ' O ' ' A' ' 25' ' ' ARG . 48.3 t -47.99 134.73 4.91 Favored 'Isoleucine or valine' 0 C--O 1.241 0.625 0 CA-C-O 122.687 1.232 . . . . 0.0 112.495 -176.166 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 2.7 m -104.87 178.79 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.268 -2.949 0 CA-C-N 112.511 -2.131 . . . . 0.0 109.472 -175.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -91.28 -28.02 18.05 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -175.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 . . . . . 0 N--CA 1.478 0.968 0 C-N-CA 124.743 1.217 . . . . 0.0 113.721 -174.236 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.6 mtt . . . . . 0 CA--C 1.507 -0.678 0 N-CA-C 109.635 -0.505 . . . . 0.0 109.635 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -83.08 135.84 34.69 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.449 -178.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -122.15 169.32 11.0 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.778 -178.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 92.55 -34.35 4.53 Favored Glycine 0 C--N 1.31 -0.877 0 C-N-CA 121.513 -0.375 . . . . 0.0 113.475 176.103 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 83.37 -91.92 1.63 Allowed Glycine 0 N--CA 1.436 -1.338 0 N-CA-C 109.986 -1.246 . . . . 0.0 109.986 -177.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -136.05 169.22 17.95 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 177.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.434 ' HB2' ' CG2' ' A' ' 11' ' ' THR . . . -87.06 163.06 17.24 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-O 121.371 0.605 . . . . 0.0 111.34 -179.006 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.644 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 13.3 t70 -64.19 143.06 58.17 Favored 'General case' 0 CA--C 1.48 -1.724 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.072 171.353 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -40.3 -56.83 1.88 Allowed 'General case' 0 C--N 1.299 -1.595 0 C-N-CA 126.422 1.889 . . . . 0.0 112.407 176.569 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -73.66 -25.66 60.37 Favored 'General case' 0 C--N 1.27 -2.879 0 CA-C-N 114.682 -1.144 . . . . 0.0 110.771 -174.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.519 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 2.2 m -68.31 -44.98 74.19 Favored 'General case' 0 N--CA 1.398 -3.064 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 175.553 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.644 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 75.1 mt-30 -55.41 -61.62 2.22 Favored 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 123.761 0.825 . . . . 0.0 112.484 -175.751 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.4 ptm180 -51.23 -41.56 60.4 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 121.373 0.606 . . . . 0.0 112.32 179.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.6 m -72.53 -44.25 62.43 Favored 'General case' 0 C--N 1.291 -1.954 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.792 -176.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.551 ' CG ' ' HZ2' ' A' ' 99' ' ' LYS . 23.2 t0 -76.04 -19.6 58.49 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.144 -174.406 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.572 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 27.4 mm -87.71 -31.07 5.71 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.159 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.024 176.242 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.522 ' O ' ' HG3' ' A' ' 21' ' ' LYS . . . -59.36 -35.09 73.24 Favored 'General case' 0 CA--C 1.498 -1.029 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 -177.828 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 7.3 m -53.8 -53.32 54.04 Favored 'General case' 0 N--CA 1.415 -2.181 0 C-N-CA 126.506 1.922 . . . . 0.0 111.048 176.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.557 ' HB3' ' HD2' ' A' ' 93' ' ' PRO . 1.6 mm? -72.1 -15.23 62.0 Favored 'General case' 1 N--CA 1.356 -5.141 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 179.951 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 11.9 mt -86.03 -24.1 26.53 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-O 121.929 0.871 . . . . 0.0 109.617 177.824 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.522 ' HG3' ' O ' ' A' ' 17' ' ' ALA . 0.1 OUTLIER -90.9 -4.12 56.79 Favored 'General case' 0 CA--C 1.5 -0.98 0 CA-C-O 122.33 1.062 . . . . 0.0 111.521 -174.25 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 32.0 m -90.07 141.44 28.67 Favored 'General case' 0 N--CA 1.389 -3.49 0 CA-C-N 113.557 -1.656 . . . . 0.0 111.048 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.1 m -108.62 166.26 10.93 Favored 'General case' 0 N--CA 1.399 -2.977 0 CA-C-N 113.734 -1.575 . . . . 0.0 110.743 178.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.537 ' H ' HD12 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -108.06 167.03 10.28 Favored 'General case' 1 N--CA 1.36 -4.936 0 CA-C-N 113.121 -1.854 . . . . 0.0 114.111 -170.897 . . . . . . . . 4 4 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.635 ' O ' HG23 ' A' ' 117' ' ' VAL . 0.0 OUTLIER -126.83 159.86 32.63 Favored 'General case' 0 C--N 1.261 -3.251 0 CA-C-N 111.423 -2.626 . . . . 0.0 104.873 -178.821 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -67.6 132.6 47.85 Favored 'General case' 0 C--N 1.289 -2.063 0 CA-C-N 117.939 0.336 . . . . 0.0 110.983 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 99.01 -2.7 58.21 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.864 -0.684 . . . . 0.0 113.559 176.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.559 ' OD2' ' HB2' ' A' ' 25' ' ' ARG . 8.3 m-20 -86.77 155.51 20.3 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 117.18 0.49 . . . . 0.0 112.179 -177.672 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.424 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 41.3 m -108.67 136.56 48.04 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.3 -178.692 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.508 ' CZ2' HD11 ' A' ' 24' ' ' LEU . 36.4 m95 -122.46 153.89 38.53 Favored 'General case' 0 N--CA 1.429 -1.515 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 176.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -106.56 129.35 54.52 Favored 'General case' 0 C--N 1.273 -2.729 0 CA-C-O 120.992 0.425 . . . . 0.0 110.246 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.727 HD12 ' CD1' ' A' ' 89' ' ' TYR . 27.1 tp -90.0 128.98 36.38 Favored 'General case' 1 N--CA 1.367 -4.625 0 CA-C-N 114.335 -1.302 . . . . 0.0 113.039 -177.229 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 55.3 t -118.09 139.77 44.02 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.012 0 C-N-CA 126.111 1.765 . . . . 0.0 108.743 -178.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.615 ' OD2' ' HB2' ' A' ' 36' ' ' ARG . 10.9 t70 -64.73 123.53 19.58 Favored 'General case' 0 C--N 1.299 -1.615 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 169.812 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.4 t -65.6 -27.55 68.49 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 120.989 0.423 . . . . 0.0 109.883 -172.564 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.615 ' HB2' ' OD2' ' A' ' 34' ' ' ASP . 67.8 mtt85 -66.95 -34.95 78.9 Favored 'General case' 0 C--O 1.243 0.752 0 C-N-CA 123.459 0.704 . . . . 0.0 110.236 -177.608 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 69.7 t90 -71.34 -46.25 60.99 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 175.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 30.3 t80 -58.6 -41.44 85.83 Favored 'General case' 0 CA--C 1.549 0.937 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.979 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.562 ' O ' ' HG3' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -51.32 -48.87 62.23 Favored 'General case' 0 CA--C 1.489 -1.395 0 CA-C-N 118.231 0.468 . . . . 0.0 111.178 173.075 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 22.4 tp60 -60.12 -43.92 95.29 Favored 'General case' 0 N--CA 1.409 -2.498 0 O-C-N 123.796 0.685 . . . . 0.0 110.634 -177.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 76.5 t90 -61.07 -39.99 91.97 Favored 'General case' 0 C--O 1.214 -0.77 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.451 178.526 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.48 ' HD3' ' HA ' ' A' ' 39' ' ' LYS . 14.4 mtpp -60.1 -41.0 91.57 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-O 120.927 0.394 . . . . 0.0 111.742 -178.494 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.562 ' HG3' ' O ' ' A' ' 39' ' ' LYS . 18.3 mtpp -73.57 -39.06 64.94 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 -175.316 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.507 ' O ' ' HA ' ' A' ' 55' ' ' MET . 0.2 OUTLIER -67.41 -44.34 79.03 Favored 'General case' 0 N--CA 1.428 -1.543 0 CA-C-N 114.173 -1.376 . . . . 0.0 111.205 -179.654 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.453 ' CG1' ' HB2' ' A' ' 47' ' ' PHE . 2.3 p -85.14 -12.34 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.608 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.323 -174.85 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 66.33 43.15 93.39 Favored Glycine 0 N--CA 1.44 -1.086 0 N-CA-C 109.879 -1.288 . . . . 0.0 109.879 -175.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.453 ' HB2' ' CG1' ' A' ' 45' ' ' VAL . 88.2 t80 -64.82 -40.51 95.32 Favored 'General case' 0 N--CA 1.437 -1.111 0 C-N-CA 123.802 0.841 . . . . 0.0 108.976 -179.039 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.473 ' O ' ' HB2' ' A' ' 52' ' ' LYS . 7.4 m-20 -95.64 132.74 40.48 Favored 'General case' 0 C--N 1.298 -1.639 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 179.253 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.2 m -69.11 -22.44 63.97 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-O 121.488 0.661 . . . . 0.0 111.982 -179.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 38.7 p90 -99.3 2.3 45.34 Favored 'General case' 0 C--N 1.302 -1.489 0 C-N-CA 123.512 0.725 . . . . 0.0 110.379 -177.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.495 ' OD2' ' HG2' ' A' ' 43' ' ' LYS . 14.9 t70 -150.18 73.15 1.14 Allowed 'General case' 0 CA--C 1.472 -2.03 0 N-CA-C 103.608 -2.738 . . . . 0.0 103.608 -176.634 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 48' ' ' ASP 0.386 53.4 tptt -142.57 13.89 1.95 Allowed 'General case' 0 N--CA 1.393 -3.3 0 CA-C-N 110.661 -2.972 . . . . 0.0 109.237 -157.733 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 59.7 m-85 -99.36 -13.28 19.67 Favored 'General case' 0 C--N 1.293 -1.88 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.435 -173.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.463 ' HB3' HG13 ' A' ' 60' ' ' VAL . 43.0 mt-30 -97.94 6.98 47.08 Favored 'General case' 0 N--CA 1.426 -1.644 0 N-CA-C 107.961 -1.125 . . . . 0.0 107.961 176.605 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' MET . . . . . 0.507 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 56.7 ttp -63.63 116.02 5.27 Favored 'General case' 0 N--CA 1.412 -2.352 0 CA-C-N 114.795 -1.093 . . . . 0.0 109.848 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.73 18.26 75.73 Favored Glycine 0 N--CA 1.429 -1.796 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.612 -179.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.523 ' HB3' HG23 ' A' ' 60' ' ' VAL . 9.3 t0 -94.34 143.95 25.96 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 179.313 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.452 ' O ' ' HD2' ' A' ' 61' ' ' TYR . 13.7 pt20 -84.3 -15.79 45.37 Favored 'General case' 0 C--N 1.291 -1.95 0 CA-C-O 122.007 0.908 . . . . 0.0 110.647 -179.198 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 -64.71 -28.06 69.34 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-N 114.659 -1.155 . . . . 0.0 111.217 177.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.523 HG23 ' HB3' ' A' ' 57' ' ' ASP . 33.2 m -115.65 1.82 8.12 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.099 0 CA-C-N 114.952 -1.022 . . . . 0.0 112.089 -172.038 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.452 ' HD2' ' O ' ' A' ' 58' ' ' GLN . 0.8 OUTLIER -64.87 118.13 45.68 Favored Pre-proline 0 C--N 1.307 -1.266 0 C-N-CA 119.638 -0.825 . . . . 0.0 109.696 -178.988 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 61' ' ' TYR . 18.4 Cg_endo -87.46 113.8 0.95 Allowed 'Trans proline' 0 N--CA 1.412 -3.282 0 C-N-CA 122.429 2.086 . . . . 0.0 109.828 177.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -73.26 -134.35 0.23 Allowed Glycine 0 C--N 1.275 -2.816 0 CA-C-N 114.233 -1.348 . . . . 0.0 112.105 177.115 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -56.65 131.06 43.31 Favored 'Trans proline' 0 CA--C 1.502 -1.108 0 C-N-CA 122.518 2.146 . . . . 0.0 112.357 -177.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.56 ' O ' HD22 ' A' ' 106' ' ' LEU . 96.2 mt -58.56 112.44 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.551 0 CA-C-N 114.365 -1.288 . . . . 0.0 109.505 177.185 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -106.86 103.45 12.89 Favored 'General case' 0 C--N 1.288 -2.095 0 N-CA-C 107.073 -1.455 . . . . 0.0 107.073 178.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.525 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 90.3 m-20 -90.74 6.22 45.0 Favored 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.818 173.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.8 m -54.13 -29.95 47.06 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.583 1.153 . . . . 0.0 111.971 -177.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -64.94 -25.16 70.58 Favored Glycine 0 CA--C 1.523 0.589 0 C-N-CA 121.59 -0.338 . . . . 0.0 112.295 178.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 72.8 mt -92.22 -23.03 19.48 Favored 'General case' 0 CA--C 1.496 -1.097 0 CA-C-O 120.816 0.341 . . . . 0.0 110.198 179.099 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 67' ' ' ASN . 21.5 mt -78.94 152.18 31.24 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.788 -172.418 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 72.9 mttt -60.02 168.18 1.98 Allowed 'General case' 0 N--CA 1.422 -1.875 0 CA-C-O 122.981 1.372 . . . . 0.0 114.589 177.013 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -89.09 83.43 6.54 Favored 'General case' 0 C--N 1.282 -2.343 0 CA-C-N 113.051 -1.886 . . . . 0.0 108.716 -178.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 137.38 -59.3 0.63 Allowed Glycine 0 N--CA 1.431 -1.665 0 CA-C-N 114.649 -1.16 . . . . 0.0 110.909 -178.292 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -92.32 123.51 35.71 Favored 'General case' 0 CA--C 1.508 -0.664 0 CA-C-O 120.896 0.379 . . . . 0.0 110.907 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -92.95 14.43 17.64 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 121.813 0.816 . . . . 0.0 110.1 179.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 15.2 mm-40 -119.69 7.24 11.02 Favored 'General case' 0 C--N 1.28 -2.431 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 -178.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 50.0 m -132.7 134.27 44.57 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 114.197 -1.365 . . . . 0.0 111.917 -173.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.9 mt -78.64 157.74 28.59 Favored 'General case' 0 C--N 1.315 -0.93 0 O-C-N 123.499 0.499 . . . . 0.0 109.731 175.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -72.89 158.47 35.44 Favored 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 173.054 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -90.06 -3.92 57.67 Favored 'General case' 0 C--N 1.293 -1.862 0 CA-C-O 121.075 0.464 . . . . 0.0 111.249 -178.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -99.25 11.37 39.25 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -177.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 32.6 mt -84.24 166.82 17.2 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-O 121.854 0.835 . . . . 0.0 113.162 -170.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.444 HG22 HD11 ' A' ' 87' ' ' LEU . 53.8 mt -142.23 173.61 7.21 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 N-CA-C 105.14 -2.17 . . . . 0.0 105.14 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.656 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 25.8 t70 -67.95 -142.03 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.95 0 CA-C-O 117.37 -1.3 . . . . 0.0 110.438 -179.524 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.482 ' HA ' ' O ' ' A' ' 89' ' ' TYR . 9.5 pt-20 -40.53 -18.62 0.01 OUTLIER 'General case' 0 N--CA 1.509 2.503 0 N-CA-C 117.625 2.454 . . . . 0.0 117.625 -173.09 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.444 HD11 HG22 ' A' ' 84' ' ' ILE . 21.0 mt -62.24 -51.57 67.23 Favored 'General case' 0 C--N 1.285 -2.232 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 171.049 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -102.12 -45.82 5.03 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.903 -177.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . 0.727 ' CD1' HD12 ' A' ' 32' ' ' LEU . 0.9 OUTLIER -140.3 167.89 21.08 Favored 'General case' 0 C--O 1.164 -3.416 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.669 -174.096 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 4.3 mt -136.16 146.69 28.77 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.511 0 O-C-N 120.851 -1.156 . . . . 0.0 110.665 178.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.522 ' CD2' HD11 ' A' ' 32' ' ' LEU . 64.5 mt -109.04 133.72 52.61 Favored 'General case' 0 C--N 1.291 -1.958 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.761 178.651 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.427 ' N ' HD13 ' A' ' 92' ' ' LEU . 1.0 OUTLIER -140.78 156.13 68.97 Favored Pre-proline 0 C--N 1.289 -2.038 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 -178.54 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.557 ' HD2' ' HB3' ' A' ' 19' ' ' LEU . 39.6 Cg_exo -64.58 168.9 12.19 Favored 'Trans proline' 0 C--O 1.252 1.215 0 C-N-CA 122.975 2.45 . . . . 0.0 111.225 175.789 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.413 HG23 ' ND2' ' A' ' 98' ' ' ASN . 86.9 m -45.62 -47.76 14.73 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 124.421 1.088 . . . . 0.0 109.766 172.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.466 ' O ' ' HG3' ' A' ' 99' ' ' LYS . 1.1 mp0 -51.8 -54.41 29.07 Favored 'General case' 0 C--O 1.209 -1.027 0 C-N-CA 125.421 1.488 . . . . 0.0 110.689 178.386 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.505 ' O ' HD23 ' A' ' 100' ' ' LEU . . . -54.98 -60.97 7.89 Favored Glycine 0 N--CA 1.43 -1.748 0 O-C-N 124.388 1.055 . . . . 0.0 111.273 -177.533 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 68.5 t-105 -52.13 -50.22 62.13 Favored 'General case' 0 C--N 1.308 -1.238 0 C-N-CA 124.361 1.064 . . . . 0.0 111.184 178.385 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.413 ' ND2' HG23 ' A' ' 94' ' ' THR . 89.6 m-20 -53.47 -37.21 62.45 Favored 'General case' 0 C--O 1.187 -2.208 0 CA-C-O 118.791 -0.623 . . . . 0.0 111.585 177.74 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.551 ' HZ2' ' CG ' ' A' ' 15' ' ' ASP . 87.6 mttt -69.56 -50.36 45.57 Favored 'General case' 0 N--CA 1.41 -2.449 0 CA-C-N 118.6 0.636 . . . . 0.0 109.827 -178.868 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.505 HD23 ' O ' ' A' ' 96' ' ' GLY . 0.8 OUTLIER -58.75 -38.49 78.55 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.295 0.569 . . . . 0.0 111.731 178.588 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.432 ' O ' ' HA ' ' A' ' 105' ' ' THR . 37.9 t -74.35 -31.16 27.8 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.931 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.428 178.816 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 57.9 m -72.17 -36.16 69.2 Favored 'General case' 0 N--CA 1.418 -2.071 0 CA-C-O 121.717 0.77 . . . . 0.0 109.512 -179.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' TRP . . . . . . . . . . . . . 38.4 m0 -78.57 -51.33 10.08 Favored 'General case' 0 N--CA 1.424 -1.738 0 CA-C-N 114.692 -1.14 . . . . 0.0 111.998 -176.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' TYR . . . . . 0.405 ' C ' ' HG1' ' A' ' 105' ' ' THR . 65.1 m-85 -123.2 4.39 9.21 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 114.558 1.318 . . . . 0.0 114.558 -172.427 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.432 ' HA ' ' O ' ' A' ' 101' ' ' VAL 0.271 22.8 p 54.29 174.87 0.02 OUTLIER 'General case' 0 N--CA 1.413 -2.301 0 N-CA-C 116.089 1.885 . . . . 0.0 116.089 -177.856 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.694 ' CD1' ' HD3' ' A' ' 112' ' ' PRO . 0.5 OUTLIER -98.86 179.88 4.5 Favored 'General case' 0 N--CA 1.407 -2.621 0 CA-C-N 114.961 -1.018 . . . . 0.0 108.308 -179.974 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.49 ' O ' ' HG2' ' A' ' 110' ' ' GLN . 19.5 ttm -94.95 134.58 37.46 Favored 'General case' 1 N--CA 1.347 -5.621 0 CA-C-O 122.027 0.918 . . . . 0.0 109.846 178.08 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -64.32 123.63 19.65 Favored 'General case' 0 N--CA 1.393 -3.319 0 CA-C-N 113.316 -1.766 . . . . 0.0 111.267 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 112.33 -19.01 22.73 Favored Glycine 0 N--CA 1.405 -3.371 0 C-N-CA 119.911 -1.138 . . . . 0.0 111.626 178.463 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.49 ' HG2' ' O ' ' A' ' 107' ' ' MET . 2.6 pt20 -116.6 164.52 14.48 Favored 'General case' 0 N--CA 1.406 -2.628 0 C-N-CA 119.966 -0.694 . . . . 0.0 109.64 178.435 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -135.94 144.9 50.37 Favored Pre-proline 0 C--N 1.29 -1.985 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.15 -179.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . 0.694 ' HD3' ' CD1' ' A' ' 106' ' ' LEU . 36.3 Cg_exo -42.7 132.63 5.47 Favored 'Trans proline' 0 CA--C 1.457 -3.327 0 C-N-CA 125.216 3.944 . . . . 0.0 113.427 177.305 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.441 HD11 ' N ' ' A' ' 113' ' ' ILE . 3.2 mp -93.11 106.53 18.05 Favored 'Isoleucine or valine' 1 N--CA 1.368 -4.541 0 CA-C-N 113.302 -1.772 . . . . 0.0 106.527 177.73 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . 0.424 ' HB1' ' CG2' ' A' ' 29' ' ' THR . . . -91.08 127.7 36.61 Favored 'General case' 0 N--CA 1.406 -2.649 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 177.53 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 15.2 tpt180 -121.63 129.79 53.05 Favored 'General case' 0 C--N 1.271 -2.817 0 N-CA-C 105.732 -1.951 . . . . 0.0 105.732 -177.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? -82.28 168.34 17.7 Favored 'General case' 0 C--N 1.272 -2.793 0 C-N-CA 119.687 -0.805 . . . . 0.0 109.014 176.476 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.635 HG23 ' O ' ' A' ' 25' ' ' ARG . 65.4 t -51.51 141.5 4.87 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-O 122.03 0.919 . . . . 0.0 111.157 -178.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 17.2 m -79.6 178.13 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.403 -2.814 0 CA-C-N 113.987 -1.46 . . . . 0.0 114.389 -169.011 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -89.11 -1.2 57.99 Favored 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 114.059 -1.428 . . . . 0.0 111.408 -176.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 . . . . . 0 C--N 1.307 -1.28 0 CA-C-O 119.096 -0.478 . . . . 0.0 109.761 -177.95 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.526 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . . . . . . 0 N--CA 1.441 -0.876 0 CA-C-O 120.301 0.096 . . . . 0.0 110.877 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.671 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 10.9 t70 -70.2 151.53 45.27 Favored 'General case' 0 CA--C 1.482 -1.658 0 N-CA-C 107.403 -1.332 . . . . 0.0 107.403 173.322 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 19.0 mt -60.25 -38.06 82.32 Favored 'General case' 0 C--N 1.305 -1.334 0 CA-C-O 121.083 0.468 . . . . 0.0 110.887 -175.637 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -62.14 -31.45 71.93 Favored 'General case' 0 N--CA 1.488 1.473 0 CA-C-N 114.463 -1.244 . . . . 0.0 108.485 -178.327 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.585 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 3.9 m -80.01 -49.77 11.34 Favored 'General case' 1 N--CA 1.371 -4.395 0 CA-C-N 113.427 -1.715 . . . . 0.0 110.682 178.291 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.671 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 60.0 mt-30 -51.61 -61.54 2.19 Favored 'General case' 0 C--N 1.347 0.487 0 C-N-CA 123.096 0.558 . . . . 0.0 112.085 -174.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.494 ' HA ' ' CH2' ' A' ' 41' ' ' TRP . 6.8 ppt_? -57.74 -38.84 76.04 Favored 'General case' 0 C--O 1.208 -1.109 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -179.255 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.3 t -77.75 -36.8 50.35 Favored 'General case' 0 C--N 1.282 -2.337 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.549 -175.319 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.486 ' O ' ' HB ' ' A' ' 18' ' ' THR . 9.8 t70 -70.29 -41.39 73.42 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.464 0.65 . . . . 0.0 109.632 -177.92 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.567 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 44.7 mm -71.27 -31.89 45.4 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.906 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.306 178.28 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.99 -30.73 71.14 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.978 0.894 . . . . 0.0 108.695 177.508 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.499 ' HA ' ' HE2' ' A' ' 21' ' ' LYS . 1.0 OUTLIER -71.59 -25.96 62.4 Favored 'General case' 0 N--CA 1.4 -2.96 0 CA-C-N 114.198 -1.365 . . . . 0.0 110.488 178.179 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.519 ' HB3' ' CG ' ' A' ' 93' ' ' PRO . 76.6 mt -85.2 -17.54 36.8 Favored 'General case' 0 C--N 1.282 -2.349 0 CA-C-O 121.038 0.447 . . . . 0.0 111.311 -177.268 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.567 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 12.3 mt -86.11 -26.71 25.1 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 -179.328 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.499 ' HE2' ' HA ' ' A' ' 18' ' ' THR . 0.0 OUTLIER -91.72 -5.34 53.83 Favored 'General case' 0 N--CA 1.432 -1.333 0 CA-C-N 114.458 -1.246 . . . . 0.0 110.344 177.692 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.447 ' HB ' ' HA ' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -76.43 138.82 40.58 Favored 'General case' 0 N--CA 1.415 -2.182 0 CA-C-N 113.2 -1.818 . . . . 0.0 110.868 178.727 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 71.2 m -57.56 142.96 42.77 Favored 'General case' 0 C--N 1.283 -2.318 0 CA-C-N 113.086 -1.87 . . . . 0.0 111.699 179.401 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.651 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP 0.296 0.5 OUTLIER -91.33 -27.07 18.62 Favored 'General case' 0 CA--C 1.465 -2.324 0 N-CA-C 116.743 2.127 . . . . 0.0 116.743 -175.315 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.511 ' O ' HG21 ' A' ' 117' ' ' VAL . 0.0 OUTLIER 63.67 112.01 0.03 OUTLIER 'General case' 0 C--N 1.249 -3.789 0 C-N-CA 127.782 2.433 . . . . 0.0 111.899 179.144 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -60.95 113.04 2.31 Favored 'General case' 0 C--N 1.292 -1.92 0 CA-C-O 121.233 0.539 . . . . 0.0 111.972 -177.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 103.16 7.57 43.3 Favored Glycine 0 N--CA 1.437 -1.29 0 CA-C-N 115.074 -0.966 . . . . 0.0 112.3 -177.195 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.478 ' HB2' ' HB2' ' A' ' 25' ' ' ARG . 4.8 t70 -87.39 -177.7 6.0 Favored 'General case' 0 C--O 1.248 1.013 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.473 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 40.3 m -126.74 118.06 23.95 Favored 'General case' 0 N--CA 1.424 -1.773 0 CA-C-O 121.427 0.632 . . . . 0.0 110.285 -176.601 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.651 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 18.2 m95 -107.01 164.72 11.9 Favored 'General case' 0 C--N 1.288 -2.084 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 178.903 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.415 ' O ' ' HA ' ' A' ' 91' ' ' LEU . 86.7 m-85 -122.43 137.51 54.84 Favored 'General case' 0 C--N 1.278 -2.501 0 N-CA-C 110.329 -0.249 . . . . 0.0 110.329 -178.851 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.46 ' CD1' ' HB2' ' A' ' 115' ' ' ARG . 9.5 mp -78.74 152.3 31.6 Favored 'General case' 0 C--N 1.309 -1.171 0 C-N-CA 120.275 -0.57 . . . . 0.0 111.626 178.586 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.5 HG12 ' O ' ' A' ' 34' ' ' ASP . 7.2 t -137.75 142.06 37.33 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.624 0 N-CA-C 105.691 -1.966 . . . . 0.0 105.691 172.208 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.5 ' O ' HG12 ' A' ' 33' ' ' VAL . 3.7 p-10 -71.05 141.12 50.9 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 173.878 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 33.5 p -69.48 -22.21 63.64 Favored 'General case' 0 C--N 1.285 -2.202 0 C-N-CA 120.404 -0.518 . . . . 0.0 111.814 -173.752 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 90.9 mtt180 -73.37 -40.58 64.25 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.005 -173.605 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.437 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 71.7 t90 -63.66 -48.05 78.79 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 108.28 -1.008 . . . . 0.0 108.28 178.921 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.535 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 32.6 t80 -63.29 -43.61 97.38 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-N 114.793 -1.094 . . . . 0.0 110.802 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.471 ' HA ' ' HE2' ' A' ' 42' ' ' LYS . 94.7 mttt -63.02 -34.12 76.88 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 176.698 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.437 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 17.7 tp60 -65.35 -43.87 89.51 Favored 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 172.776 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.494 ' CH2' ' HA ' ' A' ' 13' ' ' ARG . 65.6 t90 -58.94 -41.97 88.67 Favored 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 114.778 -1.101 . . . . 0.0 110.872 177.609 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.535 ' HG3' ' O ' ' A' ' 38' ' ' PHE . 40.4 mtmt -54.02 -41.89 68.51 Favored 'General case' 0 CA--C 1.507 -0.708 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 179.652 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -63.41 -49.31 74.28 Favored 'General case' 0 CA--C 1.504 -0.819 0 O-C-N 124.111 0.882 . . . . 0.0 109.89 178.525 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.592 ' HB2' HG23 ' A' ' 60' ' ' VAL . 0.1 OUTLIER -66.08 -41.4 90.73 Favored 'General case' 0 N--CA 1.427 -1.619 0 CA-C-N 114.257 -1.338 . . . . 0.0 112.003 -173.792 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.434 HG12 ' O ' ' A' ' 41' ' ' TRP . 5.7 p -90.36 -21.23 6.71 Favored 'Isoleucine or valine' 0 N--CA 1.395 -3.178 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.513 -174.269 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.638 ' HA2' ' HG3' ' A' ' 52' ' ' LYS . . . 84.78 33.05 19.9 Favored Glycine 0 N--CA 1.418 -2.51 0 C-N-CA 120.32 -0.943 . . . . 0.0 111.162 -175.719 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.419 ' HB3' ' HA ' ' A' ' 42' ' ' LYS . 49.9 t80 -74.67 -41.3 60.54 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -88.25 121.36 30.56 Favored 'General case' 0 C--N 1.311 -1.077 0 N-CA-C 107.144 -1.428 . . . . 0.0 107.144 -178.02 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 31.6 m -60.13 -15.82 26.99 Favored 'General case' 0 C--N 1.297 -1.709 0 N-CA-C 117.323 2.342 . . . . 0.0 117.323 -168.548 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 63.6 p-90 -104.07 -9.47 18.75 Favored 'General case' 0 N--CA 1.379 -3.986 0 CA-C-N 120.484 1.493 . . . . 0.0 107.67 -177.751 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -122.13 73.5 1.1 Allowed 'General case' 0 N--CA 1.423 -1.78 0 CA-C-N 114.954 -1.021 . . . . 0.0 109.844 -165.069 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.638 ' HG3' ' HA2' ' A' ' 46' ' ' GLY . 0.0 OUTLIER -121.5 28.29 7.8 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.179 177.829 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -81.81 -26.34 34.43 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 175.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.611 ' HB3' HG11 ' A' ' 60' ' ' VAL . 11.2 mm100 -97.83 0.94 47.67 Favored 'General case' 0 N--CA 1.413 -2.298 0 CA-C-N 114.35 -1.295 . . . . 0.0 109.995 -178.151 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' MET . . . . . 0.424 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 14.3 tmm? -64.95 116.97 6.93 Favored 'General case' 0 N--CA 1.414 -2.252 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.608 -177.607 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 83.36 3.85 89.77 Favored Glycine 0 N--CA 1.431 -1.692 0 CA-C-N 114.468 -1.242 . . . . 0.0 111.692 -179.193 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.598 ' HB3' HG22 ' A' ' 60' ' ' VAL . 5.5 t0 -82.07 147.1 29.3 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 -176.408 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -84.33 -22.3 30.65 Favored 'General case' 0 C--N 1.296 -1.751 0 CA-C-O 121.347 0.594 . . . . 0.0 110.64 -178.749 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -60.8 -31.77 71.14 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 121.925 0.869 . . . . 0.0 110.783 -179.147 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.611 HG11 ' HB3' ' A' ' 54' ' ' GLN . 27.9 m -105.99 8.49 9.66 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.123 0 CA-C-N 114.457 -1.247 . . . . 0.0 111.881 -172.729 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -60.12 119.04 38.51 Favored Pre-proline 0 C--N 1.304 -1.41 0 O-C-N 124.258 0.974 . . . . 0.0 109.349 179.326 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_endo -88.07 112.9 0.77 Allowed 'Trans proline' 0 N--CA 1.415 -3.113 0 C-N-CA 122.385 2.057 . . . . 0.0 108.905 174.142 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -68.7 -139.47 0.08 OUTLIER Glycine 0 C--N 1.288 -2.138 0 CA-C-N 114.926 -1.034 . . . . 0.0 112.56 176.856 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.46 ' HA ' ' O ' ' A' ' 104' ' ' TYR . 28.7 Cg_exo -64.32 137.42 55.85 Favored 'Trans proline' 0 C--O 1.248 0.988 0 C-N-CA 122.075 1.85 . . . . 0.0 112.048 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 65.2 mt -60.01 124.15 13.82 Favored 'Isoleucine or valine' 0 C--O 1.242 0.685 0 C-N-CA 123.389 0.676 . . . . 0.0 110.345 -178.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -116.58 104.56 11.53 Favored 'General case' 0 CA--C 1.501 -0.934 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -172.902 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.617 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 45.6 m-80 -95.0 12.43 28.47 Favored 'General case' 0 C--N 1.295 -1.778 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.567 -176.561 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 49.6 m -56.55 -34.7 67.35 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -177.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -72.26 -16.15 77.04 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 121.506 -0.378 . . . . 0.0 112.404 178.78 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 48.0 mt -93.28 -31.52 14.67 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 178.705 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.617 ' HG ' ' O ' ' A' ' 67' ' ' ASN . 70.0 mt -76.45 146.02 38.87 Favored 'General case' 0 N--CA 1.433 -1.286 0 CA-C-N 114.65 -1.159 . . . . 0.0 110.646 -176.769 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 62.8 mttt . . . . . 0 C--N 1.301 -1.501 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 -177.821 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.444 ' HA ' HD13 ' A' ' 71' ' ' LEU . . . . . . . . 0 CA--C 1.508 -0.648 0 CA-C-O 121.925 0.869 . . . . 0.0 110.028 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 38.8 mm-40 -117.04 5.58 12.83 Favored 'General case' 0 C--N 1.285 -2.203 0 CA-C-O 122.147 0.975 . . . . 0.0 108.791 -174.5 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 35.8 m -122.65 125.07 44.88 Favored 'General case' 0 C--N 1.281 -2.381 0 CA-C-N 114.007 -1.451 . . . . 0.0 109.75 -176.538 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.432 HD22 ' N ' ' A' ' 79' ' ' LEU . 2.4 mm? -85.02 151.1 24.42 Favored 'General case' 0 N--CA 1.428 -1.531 0 C-N-CA 123.361 0.664 . . . . 0.0 110.241 178.0 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.537 ' HB2' ' CD1' ' A' ' 83' ' ' LEU . 99.2 mttt -76.92 168.13 20.62 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-O 121.285 0.564 . . . . 0.0 111.377 176.88 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -74.25 -45.91 44.86 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 114.678 1.362 . . . . 0.0 114.678 -172.613 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 26.4 m-70 -81.3 -0.16 39.71 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -167.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.55 ' HB3' ' CE2' ' A' ' 89' ' ' TYR . 8.9 mp -57.3 133.02 54.76 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -179.56 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.676 HG21 HD12 ' A' ' 87' ' ' LEU . 49.5 mt -129.82 174.53 12.46 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.379 0 N-CA-C 104.926 -2.25 . . . . 0.0 104.926 177.829 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.463 ' N ' HG22 ' A' ' 84' ' ' ILE . 62.4 t0 -57.12 -151.82 0.0 OUTLIER 'General case' 0 CA--C 1.594 2.657 0 C-N-CA 126.58 1.952 . . . . 0.0 110.412 179.167 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.722 ' HA ' ' O ' ' A' ' 89' ' ' TYR 0.322 0.0 OUTLIER -39.24 -17.81 0.01 OUTLIER 'General case' 1 N--CA 1.545 4.321 0 N-CA-C 117.884 2.55 . . . . 0.0 117.884 -172.558 . . . . . . . . 5 4 . 1 . 001 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.676 HD12 HG21 ' A' ' 84' ' ' ILE . 31.5 mt -60.8 -46.26 91.18 Favored 'General case' 0 C--N 1.278 -2.531 0 C-N-CA 124.683 1.193 . . . . 0.0 110.112 171.143 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -114.69 -45.8 2.98 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-O 121.407 0.623 . . . . 0.0 109.452 -178.468 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' TYR . . . . . 0.722 ' O ' ' HA ' ' A' ' 86' ' ' GLU . 2.0 p90 -138.27 -169.45 2.59 Favored 'General case' 1 C--O 1.139 -4.72 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 -176.114 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.423 HD13 HG21 ' A' ' 90' ' ' ILE . 8.6 mt -149.05 162.85 4.68 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.903 0 N-CA-C 106.03 -1.841 . . . . 0.0 106.03 173.357 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.451 HD13 ' HA ' ' A' ' 32' ' ' LEU . 2.5 mm? -120.12 147.41 44.91 Favored 'General case' 0 N--CA 1.404 -2.77 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 172.841 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -124.38 153.53 69.05 Favored Pre-proline 0 C--N 1.271 -2.811 0 CA-C-N 114.616 -1.175 . . . . 0.0 108.689 171.685 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.519 ' CG ' ' HB3' ' A' ' 19' ' ' LEU . 5.3 Cg_endo -63.24 168.18 11.44 Favored 'Trans proline' 0 N--CA 1.432 -2.107 0 N-CA-C 107.668 -1.705 . . . . 0.0 107.668 167.063 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 14.7 m -44.36 -48.14 9.72 Favored 'General case' 0 C--N 1.298 -1.652 0 O-C-N 123.743 0.652 . . . . 0.0 110.93 175.11 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -67.13 -38.92 86.41 Favored 'General case' 0 CA--C 1.472 -2.054 0 CA-C-N 115.052 -0.976 . . . . 0.0 112.086 -177.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.521 ' O ' ' HG ' ' A' ' 100' ' ' LEU . . . -63.86 -51.08 56.54 Favored Glycine 0 N--CA 1.405 -3.37 0 C-N-CA 120.575 -0.821 . . . . 0.0 111.129 -176.983 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 63.5 t-105 -59.7 -48.98 79.51 Favored 'General case' 0 C--N 1.292 -1.913 0 CA-C-N 114.198 -1.001 . . . . 0.0 110.273 175.606 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 -51.52 -38.49 54.36 Favored 'General case' 0 C--O 1.195 -1.79 0 O-C-N 123.389 0.43 . . . . 0.0 111.641 176.132 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 28.3 mttm -66.03 -50.4 64.33 Favored 'General case' 0 CA--C 1.47 -2.109 0 CA-C-O 121.239 0.542 . . . . 0.0 110.308 -179.549 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' A' ' 96' ' ' GLY . 67.1 mt -67.61 -31.84 72.14 Favored 'General case' 0 C--N 1.275 -2.66 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.765 -176.116 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.548 ' HA ' ' HA ' ' A' ' 105' ' ' THR . 25.0 t -80.28 -24.83 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.398 -3.032 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.017 175.739 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 20.4 t -78.24 -35.05 48.8 Favored 'General case' 0 C--N 1.299 -1.626 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 178.894 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' TRP . . . . . 0.459 ' CE3' HD23 ' A' ' 100' ' ' LEU . 34.7 m0 -82.99 -48.87 10.18 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.311 -177.395 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' TYR . . . . . 0.46 ' O ' ' HA ' ' A' ' 64' ' ' PRO . 60.9 m-85 -130.54 6.74 4.82 Favored 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 -173.159 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.548 ' HA ' ' HA ' ' A' ' 101' ' ' VAL 0.27 11.1 t 48.24 -173.27 0.01 OUTLIER 'General case' 0 C--O 1.236 0.389 0 CA-C-O 123.895 1.807 . . . . 0.0 115.13 -179.71 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -105.15 151.81 23.59 Favored 'General case' 1 C--N 1.236 -4.353 0 CA-C-N 112.213 -2.267 . . . . 0.0 105.724 -174.232 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 54.4 mmm -64.14 155.96 29.95 Favored 'General case' 0 CA--C 1.495 -1.146 0 CA-C-O 121.855 0.836 . . . . 0.0 111.627 175.866 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 20.1 pm0 -75.15 137.88 41.65 Favored 'General case' 0 N--CA 1.389 -3.5 0 CA-C-N 114.346 -1.297 . . . . 0.0 109.289 178.563 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 89.72 4.12 73.27 Favored Glycine 0 N--CA 1.422 -2.244 0 CA-C-N 114.999 -1.001 . . . . 0.0 112.267 179.353 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -120.48 169.17 10.58 Favored 'General case' 0 CA--C 1.482 -1.636 0 CA-C-O 121.689 0.756 . . . . 0.0 111.634 -178.45 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -137.76 158.87 70.83 Favored Pre-proline 0 N--CA 1.412 -2.325 0 CA-C-N 114.013 -1.449 . . . . 0.0 107.091 178.217 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_exo -67.14 134.49 34.15 Favored 'Trans proline' 0 CA--C 1.459 -3.253 0 C-N-CA 122.705 2.27 . . . . 0.0 111.255 175.445 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 3.7 mp -94.76 107.03 18.87 Favored 'Isoleucine or valine' 1 N--CA 1.377 -4.121 0 CA-C-N 113.654 -1.612 . . . . 0.0 106.97 176.646 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 114' ' ' ALA . . . . . 0.473 ' HB1' ' CG2' ' A' ' 29' ' ' THR . . . -94.02 128.4 40.36 Favored 'General case' 0 N--CA 1.41 -2.452 0 CA-C-O 121.94 0.876 . . . . 0.0 111.124 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.46 ' HB2' ' CD1' ' A' ' 32' ' ' LEU . 17.0 tpt180 -119.69 120.5 36.8 Favored 'General case' 0 C--N 1.28 -2.43 0 CA-C-N 113.909 -1.496 . . . . 0.0 108.085 -175.682 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -67.81 155.94 38.19 Favored 'General case' 0 N--CA 1.424 -1.741 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 172.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.511 HG21 ' O ' ' A' ' 25' ' ' ARG . 90.8 t . . . . . 0 C--N 1.297 -1.699 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 175.235 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.341 0 CA-C-O 121.494 0.664 . . . . 0.0 112.484 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.666 ' O ' ' HB ' ' A' ' 11' ' ' THR . 0.6 OUTLIER -62.43 140.07 58.57 Favored 'General case' 0 C--O 1.207 -1.138 0 CA-C-N 114.842 -1.072 . . . . 0.0 108.811 170.298 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.507 ' O ' ' HG3' ' A' ' 13' ' ' ARG . 16.9 mt -61.08 -42.32 98.28 Favored 'General case' 0 CA--C 1.489 -1.4 0 CA-C-O 121.68 0.752 . . . . 0.0 110.77 -174.354 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -64.99 -23.67 67.29 Favored 'General case' 0 C--N 1.292 -1.91 0 CA-C-N 114.424 -1.262 . . . . 0.0 109.464 -177.603 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.666 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 2.6 m -78.42 -51.65 9.73 Favored 'General case' 0 N--CA 1.389 -3.497 0 CA-C-N 114.722 -1.126 . . . . 0.0 109.761 174.153 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.643 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 52.0 mt-30 -51.58 -53.77 34.57 Favored 'General case' 0 C--N 1.353 0.733 0 C-N-CA 123.528 0.731 . . . . 0.0 111.492 -175.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.547 ' HG2' HG13 ' A' ' 45' ' ' VAL . 45.1 mtm180 -45.06 -58.21 3.35 Favored 'General case' 0 N--CA 1.486 1.374 0 CA-C-O 121.942 0.877 . . . . 0.0 110.598 177.865 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 74.3 m -66.68 -45.96 77.19 Favored 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 113.735 -1.575 . . . . 0.0 112.769 -172.894 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.5 t0 -66.28 -39.57 89.49 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.977 -176.483 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.594 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 26.2 mm -76.07 -37.88 34.03 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.353 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.268 178.36 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.548 ' O ' ' HG2' ' A' ' 21' ' ' LYS . . . -57.79 -39.87 78.53 Favored 'General case' 0 CA--C 1.495 -1.156 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.435 ' HA ' ' HD3' ' A' ' 21' ' ' LYS . 5.7 m -60.22 -36.28 77.34 Favored 'General case' 0 N--CA 1.396 -3.143 0 CA-C-N 113.372 -1.74 . . . . 0.0 112.015 179.401 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.464 ' HB3' ' CG ' ' A' ' 93' ' ' PRO . 71.8 mt -85.65 -13.33 48.92 Favored 'General case' 0 C--N 1.269 -2.918 0 O-C-N 121.611 -0.68 . . . . 0.0 112.495 -176.755 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.594 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 16.2 mt -86.04 -25.25 26.02 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 177.101 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.548 ' HG2' ' O ' ' A' ' 17' ' ' ALA . 19.6 ptmt -91.42 -22.11 20.62 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.596 -176.926 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 16.4 m -51.06 134.95 25.98 Favored 'General case' 0 N--CA 1.402 -2.839 0 C-N-CA 125.204 1.402 . . . . 0.0 111.639 174.78 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 72.8 m -77.47 149.59 35.02 Favored 'General case' 0 N--CA 1.395 -3.2 0 CA-C-N 113.529 -1.669 . . . . 0.0 111.649 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -111.44 168.01 9.87 Favored 'General case' 0 N--CA 1.41 -2.44 0 CA-C-N 115.275 -0.875 . . . . 0.0 112.158 178.62 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.406 ' O ' HG21 ' A' ' 117' ' ' VAL . 0.0 OUTLIER -143.32 152.26 41.44 Favored 'General case' 0 C--N 1.281 -2.393 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 175.743 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -55.08 128.55 34.23 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 121.094 0.474 . . . . 0.0 110.858 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 113.3 -18.3 20.96 Favored Glycine 0 N--CA 1.424 -2.142 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.533 -177.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -72.28 141.15 48.9 Favored 'General case' 0 CA--C 1.498 -1.023 0 CA-C-N 117.288 0.544 . . . . 0.0 110.637 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 49.0 m -97.59 134.34 40.93 Favored 'General case' 0 C--N 1.294 -1.806 0 N-CA-C 107.448 -1.315 . . . . 0.0 107.448 175.8 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.425 ' HB3' ' HB3' ' A' ' 91' ' ' LEU . 39.3 m95 -120.12 137.04 54.38 Favored 'General case' 0 C--N 1.282 -2.364 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 179.662 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 67.6 m-85 -98.24 121.66 40.44 Favored 'General case' 0 C--N 1.264 -3.132 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.041 -176.071 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.782 HD11 ' CD1' ' A' ' 89' ' ' TYR . 15.9 tp -81.07 138.96 35.96 Favored 'General case' 0 N--CA 1.4 -2.933 0 CA-C-N 115.114 -0.948 . . . . 0.0 113.348 -178.588 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.494 HG12 ' O ' ' A' ' 34' ' ' ASP . 58.4 t -132.8 150.67 33.28 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.128 0 C-N-CA 126.126 1.77 . . . . 0.0 107.285 -177.947 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.684 ' HB2' HD21 ' A' ' 70' ' ' LEU . 6.8 t70 -72.16 136.86 46.61 Favored 'General case' 0 C--N 1.284 -2.264 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 169.553 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.418 ' OG ' ' HE3' ' A' ' 39' ' ' LYS . 29.1 t -68.8 -31.58 70.68 Favored 'General case' 0 C--N 1.3 -1.586 0 CA-C-O 121.028 0.442 . . . . 0.0 111.177 -174.804 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.431 ' HB2' ' OD2' ' A' ' 34' ' ' ASP . 55.7 mtt180 -69.66 -34.16 73.61 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.373 -175.073 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.494 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 76.5 t90 -67.5 -45.48 75.69 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 177.405 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.447 ' CG ' HD12 ' A' ' 90' ' ' ILE . 23.7 t80 -65.18 -39.69 93.24 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.112 -179.203 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.43 ' HA ' ' HD3' ' A' ' 42' ' ' LYS . 98.4 mttt -64.64 -33.68 76.52 Favored 'General case' 0 CA--C 1.506 -0.723 0 CA-C-O 120.898 0.38 . . . . 0.0 111.511 175.611 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.494 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 5.9 tp-100 -64.42 -44.54 90.92 Favored 'General case' 0 N--CA 1.408 -2.571 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 175.6 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 65.1 t90 -60.76 -43.4 98.04 Favored 'General case' 0 C--O 1.217 -0.633 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.396 176.54 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.594 ' HG2' ' CD1' ' A' ' 47' ' ' PHE . 15.3 mtpp -57.35 -39.29 75.62 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 123.153 0.581 . . . . 0.0 112.109 -178.204 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 40.3 mttp -72.97 -40.29 65.43 Favored 'General case' 0 C--N 1.285 -2.211 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 177.627 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.606 ' HB2' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -68.76 -38.15 79.88 Favored 'General case' 0 C--N 1.289 -2.049 0 CA-C-N 114.861 -1.063 . . . . 0.0 110.142 -176.956 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.547 HG13 ' HG2' ' A' ' 13' ' ' ARG . 4.3 p -88.79 -17.84 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.626 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.499 -176.258 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.42 ' HA2' ' CB ' ' A' ' 52' ' ' LYS . . . 83.07 27.96 38.95 Favored Glycine 0 N--CA 1.438 -1.227 0 C-N-CA 120.418 -0.896 . . . . 0.0 112.138 -174.907 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.594 ' CD1' ' HG2' ' A' ' 42' ' ' LYS . 48.8 t80 -72.73 -38.3 67.46 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 176.171 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.461 ' HB2' ' O ' ' A' ' 51' ' ' ASP . 71.4 m-20 -73.82 111.2 8.74 Favored 'General case' 0 CA--C 1.491 -1.289 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 174.213 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 11.0 m -60.95 -37.23 81.66 Favored 'General case' 0 C--N 1.297 -1.677 0 CA-C-O 121.573 0.701 . . . . 0.0 109.694 178.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 49.2 p90 -81.74 -15.55 53.97 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 114.912 -1.04 . . . . 0.0 111.336 -179.112 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.461 ' O ' ' HB2' ' A' ' 48' ' ' ASP . 7.6 t70 -141.13 86.87 2.06 Favored 'General case' 0 CA--C 1.475 -1.932 0 CA-C-O 122.364 1.078 . . . . 0.0 110.82 -175.859 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.42 ' CB ' ' HA2' ' A' ' 46' ' ' GLY . 63.7 pttt -142.33 18.77 2.07 Favored 'General case' 0 C--N 1.28 -2.427 0 CA-C-N 113.95 -1.477 . . . . 0.0 110.225 -179.295 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -60.55 -28.43 68.43 Favored 'General case' 0 C--N 1.292 -1.894 0 CA-C-N 112.747 -2.024 . . . . 0.0 107.355 172.146 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -94.8 11.92 29.82 Favored 'General case' 0 N--CA 1.421 -1.898 0 CA-C-N 113.958 -1.474 . . . . 0.0 111.661 -174.456 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' MET . . . . . 0.498 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 43.8 ttm -59.46 113.04 1.99 Allowed 'General case' 0 N--CA 1.429 -1.503 0 CA-C-O 121.013 0.435 . . . . 0.0 111.059 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.38 4.78 90.04 Favored Glycine 0 N--CA 1.437 -1.296 0 CA-C-N 115.393 -0.821 . . . . 0.0 112.569 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.574 ' HB3' HG22 ' A' ' 60' ' ' VAL . 4.8 t70 -76.46 148.99 36.86 Favored 'General case' 0 CA--C 1.509 -0.596 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 -176.735 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -83.7 -14.59 51.34 Favored 'General case' 0 C--N 1.299 -1.592 0 CA-C-O 122.117 0.96 . . . . 0.0 109.618 -178.295 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 33.2 m-80 -65.34 -25.98 67.83 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.551 175.141 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.606 HG23 ' HB2' ' A' ' 44' ' ' TYR . 34.1 m -119.9 3.19 6.87 Favored 'Isoleucine or valine' 0 CA--C 1.476 -1.871 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -172.354 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.457 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 5.3 p90 -62.43 118.11 37.36 Favored Pre-proline 0 C--N 1.308 -1.228 0 C-N-CA 119.334 -0.946 . . . . 0.0 109.291 178.691 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 61' ' ' TYR . 10.1 Cg_endo -88.63 111.04 0.6 Allowed 'Trans proline' 0 N--CA 1.418 -2.936 0 C-N-CA 122.397 2.065 . . . . 0.0 110.088 177.48 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -69.66 -153.9 0.88 Allowed Glycine 0 C--N 1.285 -2.286 0 CA-C-N 115.081 -0.963 . . . . 0.0 112.066 175.249 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.511 ' HB2' ' SD ' ' A' ' 107' ' ' MET . 88.6 Cg_exo -51.38 137.61 47.48 Favored 'Trans proline' 0 C--O 1.252 1.183 0 C-N-CA 122.929 2.419 . . . . 0.0 113.031 -179.721 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.424 HG12 ' CZ2' ' A' ' 37' ' ' TRP . 45.9 mt -64.18 110.51 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.012 0 CA-C-N 114.498 -1.228 . . . . 0.0 111.196 -175.718 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.532 ' HB2' ' HG3' ' A' ' 107' ' ' MET . 17.5 t70 -104.4 115.64 30.73 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.182 177.371 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -111.53 24.07 13.21 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.778 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 30.2 m -70.59 9.03 0.7 Allowed 'General case' 0 CA--C 1.554 1.133 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 -177.674 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -109.89 -4.97 29.47 Favored Glycine 0 CA--C 1.496 -1.105 0 C-N-CA 119.14 -1.505 . . . . 0.0 109.782 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.684 HD21 ' HB2' ' A' ' 34' ' ' ASP . 2.2 mm? -98.46 -52.99 3.46 Favored 'General case' 0 N--CA 1.418 -2.026 0 CA-C-N 113.482 -1.359 . . . . 0.0 109.797 -176.679 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.57 ' HA ' ' HA ' ' A' ' 79' ' ' LEU . 78.7 mt -59.86 147.13 39.5 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.224 -1.353 . . . . 0.0 113.842 -175.521 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.9 mtpt . . . . . 0 N--CA 1.429 -1.518 0 CA-C-N 113.98 -1.463 . . . . 0.0 108.968 176.319 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.887 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 -125.03 5.46 7.94 Favored 'General case' 0 CA--C 1.478 -1.8 0 N-CA-C 106.601 -1.629 . . . . 0.0 106.601 177.603 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.7 m -131.54 122.16 25.66 Favored 'General case' 0 C--N 1.28 -2.446 0 CA-C-N 112.594 -2.094 . . . . 0.0 109.061 -172.413 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.577 ' HG ' ' CD2' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -103.64 163.31 12.4 Favored 'General case' 0 N--CA 1.423 -1.814 0 O-C-N 123.451 0.469 . . . . 0.0 109.931 176.023 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.484 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 49.2 mtmt -60.59 116.5 4.4 Favored 'General case' 0 C--N 1.293 -1.85 0 CA-C-O 122.116 0.96 . . . . 0.0 111.802 -177.226 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.413 ' H ' ' CD ' ' A' ' 81' ' ' GLU . 1.2 pm0 -64.39 -8.99 15.22 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 115.027 1.492 . . . . 0.0 115.027 -172.776 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 46.0 m-70 -98.22 0.29 45.51 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 122.135 -0.353 . . . . 0.0 111.491 178.969 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.484 ' HG ' ' O ' ' A' ' 80' ' ' LYS . 56.6 mt -77.09 133.28 39.08 Favored 'General case' 0 C--O 1.248 1.026 0 CA-C-O 121.178 0.513 . . . . 0.0 109.808 179.719 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.62 HG21 HD12 ' A' ' 87' ' ' LEU . 49.2 mt -89.0 171.3 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.615 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 178.573 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.645 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 19.3 t70 -59.64 -139.52 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.971 0 C-N-CA 125.953 1.701 . . . . 0.0 111.041 -179.312 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.607 ' HA ' ' O ' ' A' ' 89' ' ' TYR . 0.1 OUTLIER -41.44 -18.82 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.565 0 N-CA-C 117.231 2.308 . . . . 0.0 117.231 -174.204 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.62 HD12 HG21 ' A' ' 84' ' ' ILE . 35.8 mt -60.96 -50.78 72.02 Favored 'General case' 0 C--N 1.292 -1.934 0 CA-C-O 121.57 0.7 . . . . 0.0 109.702 171.588 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -105.51 -45.79 4.35 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.794 -179.044 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' TYR . . . . . 0.782 ' CD1' HD11 ' A' ' 32' ' ' LEU . 1.5 p90 -139.09 -176.79 4.63 Favored 'General case' 0 C--O 1.161 -3.564 0 CA-C-O 119.323 -0.37 . . . . 0.0 110.703 -175.544 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.447 HD12 ' CG ' ' A' ' 38' ' ' PHE . 5.4 mt -143.48 151.53 16.8 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.472 0 CA-C-N 119.493 1.042 . . . . 0.0 109.329 176.334 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.498 HD23 ' HA ' ' A' ' 32' ' ' LEU . 64.2 mt -112.67 133.82 54.5 Favored 'General case' 0 N--CA 1.4 -2.961 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.268 175.822 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.464 HD11 HG21 ' A' ' 33' ' ' VAL . 56.0 mt -121.09 150.77 54.24 Favored Pre-proline 0 C--N 1.281 -2.404 0 CA-C-N 113.744 -1.571 . . . . 0.0 107.366 -178.419 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.464 ' CG ' ' HB3' ' A' ' 19' ' ' LEU . 72.2 Cg_endo -76.21 169.12 22.66 Favored 'Trans proline' 0 N--CA 1.429 -2.27 0 N-CA-C 107.902 -1.615 . . . . 0.0 107.902 172.508 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 58.1 m -38.25 -54.71 1.39 Allowed 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 123.999 0.92 . . . . 0.0 112.988 177.34 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -71.56 -32.44 68.11 Favored 'General case' 0 CA--C 1.498 -1.025 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -175.647 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.442 ' O ' ' HG ' ' A' ' 100' ' ' LEU . . . -59.03 -47.69 89.57 Favored Glycine 0 N--CA 1.436 -1.353 0 N-CA-C 109.99 -1.244 . . . . 0.0 109.99 177.858 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 69.1 t-105 -67.8 -50.05 58.98 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 123.512 0.725 . . . . 0.0 110.114 178.881 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -53.3 -31.29 43.26 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 179.754 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 39.7 mttm -68.39 -55.43 12.0 Favored 'General case' 0 CA--C 1.468 -2.206 0 C-N-CA 123.172 0.589 . . . . 0.0 110.309 176.822 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.481 HD23 ' CE3' ' A' ' 103' ' ' TRP . 80.9 mt -64.32 -32.83 74.59 Favored 'General case' 0 C--N 1.275 -2.635 0 CA-C-N 114.885 -1.052 . . . . 0.0 112.196 -176.076 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.404 ' O ' ' HA ' ' A' ' 105' ' ' THR . 10.3 t -78.02 -25.87 14.41 Favored 'Isoleucine or valine' 0 N--CA 1.401 -2.89 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.247 175.096 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 14.7 t -81.38 -33.87 32.03 Favored 'General case' 0 C--N 1.295 -1.787 0 O-C-N 121.425 -0.797 . . . . 0.0 109.086 178.535 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' TRP . . . . . 0.481 ' CE3' HD23 ' A' ' 100' ' ' LEU . 50.3 m0 -79.93 -45.04 19.25 Favored 'General case' 0 N--CA 1.429 -1.489 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.426 -178.118 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 33.5 m-85 -128.99 -4.05 5.09 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 115.241 1.571 . . . . 0.0 115.241 -174.383 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.404 ' HA ' ' O ' ' A' ' 101' ' ' VAL 0.279 7.9 p 58.3 167.28 0.05 OUTLIER 'General case' 0 N--CA 1.42 -1.931 0 N-CA-C 116.211 1.93 . . . . 0.0 116.211 -174.941 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 30.2 tp -92.4 157.24 16.7 Favored 'General case' 0 C--N 1.281 -2.411 0 CA-C-N 114.09 -1.414 . . . . 0.0 107.438 176.764 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' MET . . . . . 0.532 ' HG3' ' HB2' ' A' ' 66' ' ' ASP . 62.8 mmm -74.17 156.37 37.39 Favored 'General case' 0 CA--C 1.49 -1.352 0 CA-C-O 121.775 0.798 . . . . 0.0 110.428 174.553 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -89.32 153.56 20.78 Favored 'General case' 0 N--CA 1.394 -3.242 0 CA-C-N 114.32 -1.309 . . . . 0.0 109.2 -179.037 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 101.41 -29.97 11.39 Favored Glycine 0 N--CA 1.415 -2.719 0 C-N-CA 119.873 -1.156 . . . . 0.0 110.965 -176.563 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -117.14 177.09 4.84 Favored 'General case' 0 N--CA 1.421 -1.904 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -135.09 160.31 68.77 Favored Pre-proline 0 C--N 1.298 -1.661 0 N-CA-C 106.925 -1.509 . . . . 0.0 106.925 -178.36 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -55.99 122.66 12.16 Favored 'Trans proline' 0 CA--C 1.459 -3.256 0 C-N-CA 122.723 2.282 . . . . 0.0 111.054 177.611 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.416 ' HB ' ' HB3' ' A' ' 32' ' ' LEU . 33.8 mt -79.63 105.93 9.9 Favored 'Isoleucine or valine' 1 N--CA 1.379 -4.002 0 CA-C-N 113.05 -1.887 . . . . 0.0 106.957 -179.375 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -98.22 129.97 44.95 Favored 'General case' 0 C--N 1.266 -3.065 0 CA-C-O 121.913 0.863 . . . . 0.0 110.767 -178.453 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.541 ' NE ' ' HA ' ' A' ' 115' ' ' ARG . 4.0 mmp_? -124.33 -174.47 3.02 Favored 'General case' 0 N--CA 1.395 -3.209 0 N-CA-C 105.111 -2.181 . . . . 0.0 105.111 176.552 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 61.3 pttt -153.01 173.85 14.9 Favored 'General case' 0 C--N 1.254 -3.566 0 C-N-CA 119.822 -0.751 . . . . 0.0 109.658 -177.662 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.406 HG21 ' O ' ' A' ' 25' ' ' ARG . 21.4 t . . . . . 0 C--N 1.295 -1.791 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 172.613 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.466 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . . . . . . 0 CA--C 1.506 -0.742 0 CA-C-O 120.652 0.263 . . . . 0.0 110.525 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.66 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 15.0 t70 -67.4 145.47 55.02 Favored 'General case' 0 CA--C 1.483 -1.605 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 175.199 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.407 ' O ' ' HG2' ' A' ' 13' ' ' ARG . 38.1 mt -55.07 -41.79 71.96 Favored 'General case' 0 CA--C 1.494 -1.18 0 CA-C-N 119.03 0.832 . . . . 0.0 110.234 -177.847 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -69.0 -35.9 77.22 Favored 'General case' 0 CA--C 1.494 -1.206 0 CA-C-N 114.461 -1.245 . . . . 0.0 109.989 -177.654 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.5 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 5.4 m -65.2 -52.37 55.15 Favored 'General case' 0 N--CA 1.389 -3.522 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.028 177.042 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.66 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 79.1 mt-30 -49.31 -54.07 18.84 Favored 'General case' 0 CA--C 1.504 -0.806 0 C-N-CA 124.444 1.097 . . . . 0.0 111.934 -177.882 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.407 ' HG2' ' O ' ' A' ' 9' ' ' LEU . 10.7 ptt180 -64.01 -43.46 95.55 Favored 'General case' 0 N--CA 1.434 -1.256 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.646 -174.29 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 44.7 m -69.27 -44.52 71.71 Favored 'General case' 0 C--N 1.288 -2.07 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.244 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -63.81 -37.54 87.75 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.023 0.929 . . . . 0.0 109.962 -175.461 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.529 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 34.7 mm -78.97 -37.45 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.164 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.299 177.8 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.72 -36.71 77.11 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 -178.146 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 1.3 m -62.48 -32.95 73.93 Favored 'General case' 0 N--CA 1.412 -2.353 0 C-N-CA 124.786 1.234 . . . . 0.0 111.757 177.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 69.0 mt -85.86 -14.01 46.24 Favored 'General case' 0 C--N 1.278 -2.53 0 O-C-N 121.251 -0.906 . . . . 0.0 111.7 -177.425 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 14.3 mt -84.67 -26.13 27.99 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 177.113 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.406 ' H ' ' HG3' ' A' ' 21' ' ' LYS . 0.1 OUTLIER -91.39 -13.95 31.51 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-O 122.275 1.036 . . . . 0.0 111.348 -176.859 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 5.6 m -72.33 145.06 48.05 Favored 'General case' 0 N--CA 1.402 -2.869 0 CA-C-N 113.67 -1.604 . . . . 0.0 109.386 173.694 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.7 t -100.58 161.68 13.44 Favored 'General case' 0 N--CA 1.401 -2.891 0 CA-C-O 121.7 0.762 . . . . 0.0 110.628 -176.351 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.651 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP . 0.5 OUTLIER -99.46 167.68 10.46 Favored 'General case' 0 C--N 1.294 -1.826 0 CA-C-N 114.57 -1.196 . . . . 0.0 112.829 179.782 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -104.88 -157.45 0.61 Allowed 'General case' 0 C--N 1.291 -1.948 0 N-CA-C 105.939 -1.874 . . . . 0.0 105.939 176.559 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.46 ' C ' HG21 ' A' ' 117' ' ' VAL . 16.1 ptpt -119.39 29.98 7.35 Favored 'General case' 0 N--CA 1.414 -2.259 0 CA-C-O 121.478 0.656 . . . . 0.0 110.352 172.095 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.502 ' N ' HG21 ' A' ' 117' ' ' VAL . . . -149.78 20.34 1.14 Allowed Glycine 0 CA--C 1.54 1.618 0 CA-C-N 114.831 -1.077 . . . . 0.0 114.165 176.223 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.441 ' H ' HG11 ' A' ' 117' ' ' VAL . 10.9 m-20 -96.15 -174.48 3.1 Favored 'General case' 0 N--CA 1.491 1.588 0 CA-C-N 118.544 1.172 . . . . 0.0 110.055 -178.752 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.405 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 90.1 m -133.71 127.44 32.84 Favored 'General case' 0 N--CA 1.425 -1.698 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 170.953 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.651 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 17.1 m95 -114.33 163.72 14.9 Favored 'General case' 0 C--N 1.277 -2.584 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.453 ' HB2' ' HB2' ' A' ' 97' ' ' TRP . 89.1 m-85 -123.46 141.87 51.57 Favored 'General case' 0 C--N 1.278 -2.505 0 C-N-CA 121.069 -0.252 . . . . 0.0 111.507 -175.605 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.618 HD13 HG22 ' A' ' 113' ' ' ILE . 5.5 mp -92.04 134.64 34.63 Favored 'General case' 0 CA--C 1.461 -2.452 0 O-C-N 124.54 1.15 . . . . 0.0 111.512 -179.71 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.438 HG12 ' O ' ' A' ' 34' ' ' ASP . 95.8 t -116.52 142.65 29.21 Favored 'Isoleucine or valine' 0 C--N 1.251 -3.69 0 N-CA-C 102.932 -2.988 . . . . 0.0 102.932 171.853 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.438 ' O ' HG12 ' A' ' 33' ' ' VAL . 10.2 p-10 -72.75 136.7 45.55 Favored 'General case' 0 C--N 1.278 -2.541 0 N-CA-C 106.897 -1.52 . . . . 0.0 106.897 174.004 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 61.9 p -62.3 -28.36 69.68 Favored 'General case' 0 C--N 1.272 -2.802 0 CA-C-N 114.278 -1.328 . . . . 0.0 110.024 -173.092 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.9 mmt85 -69.96 -45.78 66.67 Favored 'General case' 0 N--CA 1.423 -1.824 0 CA-C-N 114.02 -1.446 . . . . 0.0 110.058 -173.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.522 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 69.1 t90 -67.61 -44.19 78.65 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 179.36 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.446 ' CG ' HD12 ' A' ' 90' ' ' ILE . 38.4 t80 -61.86 -37.83 85.99 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.185 -178.942 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -73.78 -23.66 59.73 Favored 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 121.693 -0.629 . . . . 0.0 112.627 178.563 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.522 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 5.9 tp-100 -70.29 -42.61 71.84 Favored 'General case' 0 N--CA 1.412 -2.341 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 172.114 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.447 ' O ' HG22 ' A' ' 45' ' ' VAL . 78.4 t90 -62.31 -39.39 92.88 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-N 114.241 -1.345 . . . . 0.0 110.529 176.941 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.535 ' HG2' ' CD2' ' A' ' 47' ' ' PHE . 11.5 mtpp -55.57 -46.77 77.16 Favored 'General case' 0 CA--C 1.498 -1.032 0 C-N-CA 123.265 0.626 . . . . 0.0 111.683 178.475 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -57.66 -52.5 65.19 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 124.766 1.291 . . . . 0.0 110.727 178.7 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.649 ' HB2' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -60.61 -36.42 78.56 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 113.594 -1.639 . . . . 0.0 114.226 -175.241 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.447 HG22 ' O ' ' A' ' 41' ' ' TRP . 18.8 m -95.95 -17.26 6.99 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.781 0 N-CA-C 113.234 0.827 . . . . 0.0 113.234 -178.842 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.568 ' HA2' ' CB ' ' A' ' 52' ' ' LYS . . . 79.79 38.12 20.92 Favored Glycine 0 N--CA 1.4 -3.743 0 C-N-CA 119.949 -1.12 . . . . 0.0 110.967 -172.698 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.535 ' CD2' ' HG2' ' A' ' 42' ' ' LYS . 75.9 t80 -63.22 -40.43 97.44 Favored 'General case' 0 N--CA 1.442 -0.827 0 C-N-CA 123.022 0.529 . . . . 0.0 111.562 -176.689 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.663 ' HB3' ' HB3' ' A' ' 51' ' ' ASP . 3.5 t70 -92.3 -178.95 5.09 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 -174.796 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' SER . . . . . 0.463 ' O ' ' HE2' ' A' ' 52' ' ' LYS . 20.8 m -84.94 -37.17 20.85 Favored 'General case' 0 C--N 1.294 -1.822 0 N-CA-C 111.755 0.279 . . . . 0.0 111.755 -176.696 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 66.7 p-90 -105.13 -21.14 13.32 Favored 'General case' 0 N--CA 1.39 -3.471 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 -178.344 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.663 ' HB3' ' HB3' ' A' ' 48' ' ' ASP . 31.7 t0 -94.98 73.29 3.46 Favored 'General case' 0 CA--C 1.461 -2.449 0 CA-C-N 114.071 -1.422 . . . . 0.0 108.776 -170.839 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.568 ' CB ' ' HA2' ' A' ' 46' ' ' GLY . 65.2 pttt -162.39 9.68 0.06 Allowed 'General case' 0 N--CA 1.415 -2.192 0 CA-C-N 112.689 -2.051 . . . . 0.0 114.058 -174.769 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -63.53 -22.9 67.15 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-O 122.639 1.209 . . . . 0.0 108.101 171.719 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.472 ' HB3' HG11 ' A' ' 60' ' ' VAL . 4.5 mt-30 -94.48 11.34 31.13 Favored 'General case' 0 N--CA 1.427 -1.594 0 CA-C-N 113.426 -1.715 . . . . 0.0 110.858 -175.817 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 46.5 ttm -62.11 115.13 3.85 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 110.067 -0.345 . . . . 0.0 110.067 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.03 20.55 77.5 Favored Glycine 0 N--CA 1.44 -1.094 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.824 -179.186 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.525 ' HB3' HG22 ' A' ' 60' ' ' VAL . 5.7 t0 -91.83 147.6 22.86 Favored 'General case' 0 CA--C 1.503 -0.846 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 -179.302 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.442 ' O ' ' HD2' ' A' ' 61' ' ' TYR . 19.4 pt20 -83.21 -17.56 42.35 Favored 'General case' 0 C--N 1.296 -1.72 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 -62.39 -25.26 67.83 Favored 'General case' 0 CA--C 1.492 -1.27 0 CA-C-N 115.043 -0.981 . . . . 0.0 111.41 177.699 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.649 HG23 ' HB2' ' A' ' 44' ' ' TYR . 26.5 m -121.19 7.44 6.07 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.824 0 CA-C-N 115.028 -0.987 . . . . 0.0 112.099 -172.401 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.442 ' HD2' ' O ' ' A' ' 58' ' ' GLN . 0.9 OUTLIER -62.73 116.53 24.41 Favored Pre-proline 0 C--N 1.305 -1.342 0 O-C-N 124.052 0.845 . . . . 0.0 111.067 -178.419 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 61' ' ' TYR . 15.0 Cg_endo -89.78 117.97 0.75 Allowed 'Trans proline' 0 N--CA 1.41 -3.399 0 C-N-CA 122.699 2.266 . . . . 0.0 111.422 177.555 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -73.45 -153.67 2.64 Favored Glycine 0 C--N 1.273 -2.95 0 CA-C-N 113.806 -1.543 . . . . 0.0 111.253 171.046 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.4 ' HB2' ' SD ' ' A' ' 107' ' ' MET . 52.3 Cg_exo -55.83 143.06 82.76 Favored 'Trans proline' 0 C--O 1.245 0.859 0 C-N-CA 122.82 2.347 . . . . 0.0 112.662 -178.547 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.444 HD11 ' HB3' ' A' ' 100' ' ' LEU . 42.2 mt -64.95 114.07 2.3 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.115 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.82 -176.768 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.582 ' HB2' ' HG3' ' A' ' 107' ' ' MET . 24.4 t70 -113.35 104.96 12.83 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 116.022 -0.535 . . . . 0.0 109.769 178.687 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -91.22 19.51 5.84 Favored 'General case' 0 C--N 1.303 -1.419 0 CA-C-N 116.925 -0.125 . . . . 0.0 111.245 -176.12 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 33.2 t -54.75 -31.66 58.8 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -176.004 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -66.06 -18.25 66.62 Favored Glycine 0 CA--C 1.527 0.79 0 C-N-CA 121.296 -0.478 . . . . 0.0 113.446 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 32.1 mt -93.61 -21.61 19.3 Favored 'General case' 0 C--O 1.247 0.928 0 CA-C-O 121.395 0.617 . . . . 0.0 109.388 179.678 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.555 HD13 ' HA ' ' A' ' 76' ' ' ALA . 50.3 mt -79.87 137.6 36.97 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.713 -173.625 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt . . . . . 0 C--O 1.246 0.891 0 CA-C-O 122.264 1.031 . . . . 0.0 111.135 178.24 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.555 ' HA ' HD13 ' A' ' 71' ' ' LEU . . . . . . . . 0 N--CA 1.438 -1.035 0 CA-C-O 121.939 0.876 . . . . 0.0 109.629 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 23.2 mm-40 -114.94 3.13 14.45 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.238 178.603 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 94.7 p -98.13 113.04 24.81 Favored 'General case' 0 C--N 1.297 -1.683 0 CA-C-N 115.164 -0.926 . . . . 0.0 111.343 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.593 HD11 HG21 ' A' ' 113' ' ' ILE . 3.0 mm? -93.68 141.87 28.0 Favored 'General case' 0 N--CA 1.425 -1.705 0 C-N-CA 123.867 0.867 . . . . 0.0 111.459 -179.667 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -61.69 139.27 58.32 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.318 0.58 . . . . 0.0 111.163 175.179 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.566 ' H ' ' CD ' ' A' ' 81' ' ' GLU . 0.4 OUTLIER -58.56 -48.07 82.11 Favored 'General case' 0 C--N 1.301 -1.501 0 C-N-CA 124.838 1.255 . . . . 0.0 110.139 -176.445 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 71.9 m80 -84.85 12.06 8.11 Favored 'General case' 0 C--N 1.295 -1.793 0 CA-C-N 113.971 -1.468 . . . . 0.0 114.053 -170.703 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 74.9 mt -60.49 119.59 8.32 Favored 'General case' 0 C--O 1.24 0.604 0 CA-C-O 120.879 0.371 . . . . 0.0 111.965 178.354 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.74 HG21 HD12 ' A' ' 87' ' ' LEU . 51.2 mt -98.89 171.78 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.434 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 173.514 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.589 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 24.0 t70 -62.87 -139.08 0.0 OUTLIER 'General case' 0 C--O 1.185 -2.292 0 C-N-CA 125.183 1.393 . . . . 0.0 111.497 -177.864 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.687 ' HA ' ' O ' ' A' ' 89' ' ' TYR 0.271 1.0 OUTLIER -40.72 -20.54 0.01 OUTLIER 'General case' 0 N--CA 1.535 3.799 0 N-CA-C 117.018 2.229 . . . . 0.0 117.018 -173.192 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.74 HD12 HG21 ' A' ' 84' ' ' ILE . 66.1 mt -60.81 -57.98 10.37 Favored 'General case' 0 C--N 1.281 -2.39 0 C-N-CA 124.124 0.97 . . . . 0.0 109.645 171.208 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.527 ' HB2' ' O ' ' A' ' 84' ' ' ILE . 10.2 m-20 -97.86 -49.21 4.89 Favored 'General case' 0 CA--C 1.491 -1.295 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.06 -178.659 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' TYR . . . . . 0.687 ' O ' ' HA ' ' A' ' 86' ' ' GLU . 5.4 p90 -135.39 -165.87 1.75 Allowed 'General case' 0 C--O 1.16 -3.62 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 -175.214 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.555 ' O ' ' HA ' ' A' ' 32' ' ' LEU . 9.0 mt -147.05 149.75 15.4 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.316 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 169.261 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.531 HD21 ' CD1' ' A' ' 32' ' ' LEU . 37.2 mt -118.56 122.16 41.96 Favored 'General case' 0 N--CA 1.412 -2.34 0 O-C-N 124.453 1.096 . . . . 0.0 112.432 178.548 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.477 HD12 ' N ' ' A' ' 92' ' ' LEU . 1.7 mp -129.88 157.56 76.44 Favored Pre-proline 0 C--N 1.3 -1.546 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 -178.35 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -63.77 169.56 9.95 Favored 'Trans proline' 0 CA--C 1.5 -1.204 0 C-N-CA 122.442 2.095 . . . . 0.0 110.243 176.205 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 18.5 m -36.71 -56.4 0.84 Allowed 'General case' 0 C--N 1.322 -0.601 0 O-C-N 124.611 1.194 . . . . 0.0 110.738 170.398 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -59.2 -36.86 76.11 Favored 'General case' 0 C--O 1.199 -1.575 0 C-N-CA 124.812 1.245 . . . . 0.0 112.392 -174.561 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.596 ' O ' HD22 ' A' ' 100' ' ' LEU . . . -59.02 -62.74 5.88 Favored Glycine 0 N--CA 1.423 -2.23 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 179.363 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.453 ' HB2' ' HB2' ' A' ' 31' ' ' TYR . 68.8 t-105 -52.69 -49.79 64.6 Favored 'General case' 0 C--N 1.315 -0.893 0 C-N-CA 124.717 1.207 . . . . 0.0 110.488 177.686 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.481 ' O ' ' HB2' ' A' ' 102' ' ' SER . 34.4 t30 -53.49 -31.49 46.13 Favored 'General case' 0 N--CA 1.419 -2.014 0 C-N-CA 126.787 2.035 . . . . 0.0 111.962 178.339 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 52.7 mttm -78.22 -49.57 13.51 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-N 118.103 0.41 . . . . 0.0 110.402 174.638 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.596 HD22 ' O ' ' A' ' 96' ' ' GLY . 1.0 OUTLIER -57.4 -42.72 82.79 Favored 'General case' 0 C--O 1.24 0.567 0 CA-C-O 121.476 0.655 . . . . 0.0 111.362 -179.484 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 49.1 t -71.66 -27.99 29.79 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.809 0 C-N-CA 123.768 0.827 . . . . 0.0 111.091 177.914 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' SER . . . . . 0.481 ' HB2' ' O ' ' A' ' 98' ' ' ASN . 22.7 t -71.23 -34.08 70.46 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 178.65 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' TRP . . . . . . . . . . . . . 41.1 m0 -83.96 -54.0 5.17 Favored 'General case' 0 N--CA 1.423 -1.811 0 CA-C-N 115.266 -0.879 . . . . 0.0 112.239 -175.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -127.51 10.72 6.73 Favored 'General case' 0 CA--C 1.502 -0.88 0 N-CA-C 114.359 1.244 . . . . 0.0 114.359 -173.423 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 24.8 p 56.64 172.0 0.04 OUTLIER 'General case' 0 N--CA 1.411 -2.385 0 N-CA-C 116.774 2.139 . . . . 0.0 116.774 178.313 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.07 153.37 17.68 Favored 'General case' 0 C--N 1.282 -2.337 0 N-CA-C 105.831 -1.914 . . . . 0.0 105.831 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' MET . . . . . 0.582 ' HG3' ' HB2' ' A' ' 66' ' ' ASP . 65.3 mmm -64.62 156.17 30.94 Favored 'General case' 0 CA--C 1.493 -1.225 0 CA-C-O 121.299 0.571 . . . . 0.0 110.348 173.418 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -74.78 149.03 39.86 Favored 'General case' 0 N--CA 1.407 -2.609 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.043 -179.201 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 83.47 -34.55 2.89 Favored Glycine 0 N--CA 1.423 -2.183 0 CA-C-N 115.251 -0.886 . . . . 0.0 112.109 -178.258 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -79.0 150.67 31.89 Favored 'General case' 0 N--CA 1.411 -2.395 0 CA-C-O 121.302 0.573 . . . . 0.0 111.116 179.481 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -133.01 146.42 61.19 Favored Pre-proline 0 N--CA 1.406 -2.646 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -48.63 128.39 18.17 Favored 'Trans proline' 0 CA--C 1.467 -2.825 0 C-N-CA 124.097 3.198 . . . . 0.0 114.544 -174.339 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.618 HG22 HD13 ' A' ' 32' ' ' LEU . 45.9 mt -85.21 107.47 16.08 Favored 'Isoleucine or valine' 1 N--CA 1.371 -4.384 0 CA-C-N 113.28 -1.782 . . . . 0.0 106.879 175.809 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 114' ' ' ALA . . . . . 0.405 ' HB1' ' CG2' ' A' ' 29' ' ' THR . . . -103.86 135.64 45.03 Favored 'General case' 0 C--N 1.275 -2.656 0 CA-C-O 121.446 0.641 . . . . 0.0 110.823 -178.491 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.531 ' HB2' HD11 ' A' ' 32' ' ' LEU . 13.2 tpt180 -136.25 126.97 27.26 Favored 'General case' 0 CA--C 1.455 -2.697 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 179.151 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.84 -176.27 3.82 Favored 'General case' 0 C--N 1.253 -3.622 0 CA-C-O 123.358 1.552 . . . . 0.0 112.125 179.186 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.577 HG12 ' HB2' ' A' ' 24' ' ' LEU . 9.0 m . . . . . 1 N--CA 1.371 -4.394 0 CA-C-N 111.249 -2.705 . . . . 0.0 111.77 172.69 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.588 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . . . . . . 0 N--CA 1.422 -1.844 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.601 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 23.3 t70 -69.02 151.35 46.6 Favored 'General case' 0 C--O 1.194 -1.847 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 174.825 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -41.05 -52.49 3.18 Favored 'General case' 0 C--N 1.307 -1.258 0 C-N-CA 126.263 1.825 . . . . 0.0 112.447 177.373 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -68.91 -31.02 69.62 Favored 'General case' 0 C--N 1.271 -2.808 0 CA-C-N 113.593 -1.639 . . . . 0.0 110.221 -175.504 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.588 ' CG2' ' HB1' ' A' ' 7' ' ' ALA . 16.5 m -73.65 -44.3 57.18 Favored 'General case' 1 N--CA 1.377 -4.098 0 CA-C-N 114.57 -1.196 . . . . 0.0 110.786 177.847 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.601 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 45.9 mt-30 -56.78 -57.27 13.17 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 122.651 0.38 . . . . 0.0 111.589 -173.512 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.501 ' HB3' HG13 ' A' ' 45' ' ' VAL . 0.0 OUTLIER -52.95 -41.37 64.44 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-O 121.151 0.501 . . . . 0.0 112.165 177.029 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.5 m -69.72 -47.16 64.09 Favored 'General case' 0 C--N 1.291 -1.965 0 CA-C-N 115.668 -0.697 . . . . 0.0 111.572 -178.87 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.575 ' O ' ' HB ' ' A' ' 18' ' ' THR . 13.5 t70 -61.31 -43.75 98.36 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 124.487 1.115 . . . . 0.0 110.64 -178.079 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.61 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 32.0 mm -72.88 -37.26 54.0 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.998 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.055 -178.375 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.405 ' O ' ' HG3' ' A' ' 21' ' ' LYS . . . -61.6 -36.99 82.27 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.575 ' HB ' ' O ' ' A' ' 15' ' ' ASP . 6.3 m -62.15 -33.99 75.55 Favored 'General case' 0 N--CA 1.408 -2.549 0 C-N-CA 125.898 1.679 . . . . 0.0 111.741 178.314 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 73.5 mt -85.79 -13.95 46.64 Favored 'General case' 0 C--N 1.27 -2.875 0 O-C-N 121.258 -0.901 . . . . 0.0 111.886 -177.613 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.61 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 14.3 mt -86.33 -26.88 24.64 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.611 0.72 . . . . 0.0 109.485 177.376 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.405 ' HG3' ' O ' ' A' ' 17' ' ' ALA . 0.1 OUTLIER -89.36 -7.66 54.81 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-O 122.35 1.071 . . . . 0.0 111.659 -174.507 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 15.2 m -75.73 136.71 40.32 Favored 'General case' 0 N--CA 1.386 -3.625 0 CA-C-N 113.207 -1.815 . . . . 0.0 110.729 176.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.5 m -75.03 142.86 43.75 Favored 'General case' 0 N--CA 1.403 -2.809 0 CA-C-N 113.724 -1.58 . . . . 0.0 111.549 178.274 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.534 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP . 0.5 OUTLIER -98.52 179.56 4.66 Favored 'General case' 0 N--CA 1.423 -1.812 0 N-CA-C 114.228 1.196 . . . . 0.0 114.228 -178.312 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.584 ' O ' HG21 ' A' ' 117' ' ' VAL . 3.6 mmp_? -127.23 -145.52 0.32 Allowed 'General case' 0 C--O 1.203 -1.383 0 C-N-CA 123.466 0.706 . . . . 0.0 110.894 -172.694 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -119.24 122.46 41.99 Favored 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 171.512 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 68.23 36.53 85.17 Favored Glycine 0 C--O 1.224 -0.493 0 N-CA-C 110.857 -0.897 . . . . 0.0 110.857 -177.086 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.455 ' HB2' ' HB2' ' A' ' 25' ' ' ARG . 34.1 t70 -79.23 -8.68 59.22 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-O 121.786 0.803 . . . . 0.0 111.989 -174.509 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.471 ' HA ' ' HA ' ' A' ' 116' ' ' LYS . 25.9 m 49.55 110.2 0.0 OUTLIER 'General case' 0 C--N 1.282 -2.344 0 C-N-CA 127.159 2.184 . . . . 0.0 114.369 -176.147 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.534 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 13.1 m95 -114.25 134.62 54.81 Favored 'General case' 0 C--N 1.3 -1.564 0 CA-C-N 114.693 -1.14 . . . . 0.0 109.172 -178.903 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -104.44 147.96 26.97 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 111.367 0.136 . . . . 0.0 111.367 -174.287 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.667 ' HA ' ' O ' ' A' ' 90' ' ' ILE . 5.8 mp -93.24 144.85 24.9 Favored 'General case' 0 CA--C 1.491 -1.307 0 N-CA-C 114.328 1.232 . . . . 0.0 114.328 -175.761 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 75.4 t -131.11 140.94 47.34 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.715 0 N-CA-C 105.871 -1.9 . . . . 0.0 105.871 173.624 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.493 ' HA ' HD11 ' A' ' 70' ' ' LEU . 20.1 t0 -64.62 131.61 47.47 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 173.689 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.44 ' O ' ' HE3' ' A' ' 39' ' ' LYS . 47.6 t -59.79 -37.54 79.39 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.262 -176.347 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 88.5 mtm180 -68.48 -34.31 75.71 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.848 -174.459 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.485 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 65.3 t90 -66.11 -46.37 77.84 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 177.984 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.532 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 32.7 t80 -64.7 -41.63 95.88 Favored 'General case' 0 C--O 1.206 -1.187 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.135 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.494 ' HG3' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.27 -38.98 69.28 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 118.394 0.543 . . . . 0.0 111.868 173.394 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.485 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 5.8 tp-100 -65.58 -41.85 92.43 Favored 'General case' 0 N--CA 1.421 -1.906 0 CA-C-O 121.279 0.562 . . . . 0.0 109.854 175.962 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.4 ' HZ2' ' HB3' ' A' ' 12' ' ' GLN . 77.1 t90 -63.09 -39.68 95.43 Favored 'General case' 0 N--CA 1.437 -1.097 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.001 178.198 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.532 ' HG3' ' O ' ' A' ' 38' ' ' PHE . 35.8 mtmt -57.65 -40.08 78.48 Favored 'General case' 0 CA--C 1.515 -0.396 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 178.518 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -61.24 -48.63 80.57 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.884 0.849 . . . . 0.0 109.862 176.594 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.631 ' HB2' HG23 ' A' ' 60' ' ' VAL . 2.1 t80 -66.48 -41.92 88.22 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 113.548 -1.66 . . . . 0.0 112.709 -175.458 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.501 HG13 ' HB3' ' A' ' 13' ' ' ARG . 1.6 p -90.54 -15.99 8.37 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.05 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.789 -173.919 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.583 ' HA2' ' HB2' ' A' ' 52' ' ' LYS . . . 75.83 33.18 51.79 Favored Glycine 0 N--CA 1.416 -2.639 0 C-N-CA 121.249 -0.5 . . . . 0.0 112.119 -176.468 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.458 ' HB2' ' CG1' ' A' ' 45' ' ' VAL . 54.4 t80 -68.36 -45.48 72.68 Favored 'General case' 0 N--CA 1.44 -0.973 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.45 ' O ' ' HB3' ' A' ' 52' ' ' LYS . 70.2 m-20 -78.81 116.29 19.05 Favored 'General case' 0 CA--C 1.491 -1.29 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 178.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 36.0 m -66.63 -27.84 68.0 Favored 'General case' 0 C--N 1.291 -1.963 0 N-CA-C 111.8 0.296 . . . . 0.0 111.8 -178.022 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 45.0 p90 -82.57 -14.39 54.94 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.59 -178.852 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -154.53 101.06 2.31 Favored 'General case' 0 CA--C 1.488 -1.413 0 CA-C-O 121.417 0.627 . . . . 0.0 110.21 -179.076 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.583 ' HB2' ' HA2' ' A' ' 46' ' ' GLY . 22.8 pttp -156.91 21.41 0.32 Allowed 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 114.66 -1.154 . . . . 0.0 111.748 -171.387 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -70.79 -4.09 22.19 Favored 'General case' 0 C--N 1.266 -3.046 0 CA-C-N 114.503 -1.226 . . . . 0.0 110.177 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.436 ' HB3' HG11 ' A' ' 60' ' ' VAL . 0.2 OUTLIER -106.87 11.71 29.71 Favored 'General case' 0 N--CA 1.403 -2.779 0 C-N-CA 124.467 1.107 . . . . 0.0 109.167 -177.3 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 55' ' ' MET . . . . . 0.589 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 50.0 ttm -60.98 103.56 0.28 Allowed 'General case' 0 N--CA 1.428 -1.555 0 C-N-CA 123.837 0.855 . . . . 0.0 110.914 179.56 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 89.54 15.69 58.04 Favored Glycine 0 N--CA 1.439 -1.117 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.873 -178.236 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.579 ' HB3' HG22 ' A' ' 60' ' ' VAL . 29.3 t0 -89.89 142.89 27.27 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 179.7 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -82.82 -16.25 48.48 Favored 'General case' 0 C--N 1.296 -1.72 0 CA-C-O 122.358 1.075 . . . . 0.0 109.061 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 66.3 m-20 -62.51 -26.3 68.47 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 114.317 -1.311 . . . . 0.0 111.171 175.537 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.631 HG23 ' HB2' ' A' ' 44' ' ' TYR . 27.3 m -123.33 1.95 5.78 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.693 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.113 -172.565 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -66.37 119.56 63.35 Favored Pre-proline 0 C--N 1.299 -1.594 0 C-N-CA 119.426 -0.91 . . . . 0.0 110.495 -178.686 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -87.22 117.07 1.25 Allowed 'Trans proline' 0 N--CA 1.413 -3.257 0 C-N-CA 122.529 2.153 . . . . 0.0 110.22 177.769 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -71.47 -145.35 0.41 Allowed Glycine 0 C--N 1.267 -3.26 0 CA-C-N 113.875 -1.511 . . . . 0.0 112.779 177.144 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -54.62 135.71 67.86 Favored 'Trans proline' 0 C--O 1.253 1.27 0 C-N-CA 123.001 2.468 . . . . 0.0 112.822 -177.779 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.568 HD11 ' HB3' ' A' ' 100' ' ' LEU . 57.2 mt -70.04 107.18 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.927 0 CA-C-N 115.133 -0.94 . . . . 0.0 112.029 -176.402 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -95.97 128.4 42.83 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.115 175.66 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.512 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 35.1 m-80 -124.21 11.82 8.83 Favored 'General case' 0 C--N 1.315 -0.933 0 O-C-N 123.96 0.787 . . . . 0.0 110.412 -179.006 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 23.0 t -59.95 -30.16 68.89 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -173.824 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -76.09 -13.28 83.37 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 121.479 -0.391 . . . . 0.0 112.547 -178.271 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.493 HD11 ' HA ' ' A' ' 34' ' ' ASP . 37.4 mt -91.08 -20.48 22.01 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 67' ' ' ASN . 44.9 mt -83.96 159.11 21.32 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.237 -170.697 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.455 ' HG3' ' C ' ' A' ' 79' ' ' LEU . 58.1 mtpt . . . . . 0 C--N 1.311 -1.081 0 CA-C-O 121.804 0.811 . . . . 0.0 111.797 178.636 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.476 ' HA ' HD13 ' A' ' 71' ' ' LEU . . . . . . . . 0 N--CA 1.445 -0.721 0 CA-C-O 122.151 0.977 . . . . 0.0 109.509 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -112.68 2.85 16.29 Favored 'General case' 0 C--N 1.303 -1.44 0 CA-C-O 122.242 1.02 . . . . 0.0 108.506 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.2 t -113.56 140.68 47.96 Favored 'General case' 0 C--N 1.287 -2.12 0 N-CA-C 106.364 -1.717 . . . . 0.0 106.364 177.581 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.505 ' HA ' ' HA ' ' A' ' 71' ' ' LEU . 1.0 OUTLIER -126.41 153.84 44.44 Favored 'General case' 0 N--CA 1.409 -2.495 0 C-N-CA 120.719 -0.392 . . . . 0.0 110.391 -174.49 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.61 ' HB2' HD13 ' A' ' 83' ' ' LEU . 66.2 mttm -55.25 144.23 25.34 Favored 'General case' 0 C--N 1.31 -1.144 0 N-CA-C 116.055 1.872 . . . . 0.0 116.055 -171.683 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -48.02 -58.24 4.71 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 127.218 2.207 . . . . 0.0 115.847 -172.868 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 41.4 m80 -91.84 -1.76 57.19 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 113.882 1.067 . . . . 0.0 113.882 -169.415 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.61 HD13 ' HB2' ' A' ' 80' ' ' LYS . 10.7 mp -59.98 127.5 32.21 Favored 'General case' 0 C--O 1.254 1.303 0 N-CA-C 115.307 1.595 . . . . 0.0 115.307 -176.796 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.65 HG21 HD12 ' A' ' 87' ' ' LEU . 61.8 mt -97.74 174.01 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 CA-C-N 112.67 -2.059 . . . . 0.0 107.029 177.876 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.517 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 18.3 t70 -61.59 -139.98 0.0 OUTLIER 'General case' 0 CA--C 1.581 2.173 0 C-N-CA 126.071 1.749 . . . . 0.0 110.684 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.63 ' HA ' ' O ' ' A' ' 89' ' ' TYR 0.252 0.2 OUTLIER -40.33 -18.86 0.01 OUTLIER 'General case' 0 N--CA 1.517 2.875 0 C-N-CA 127.333 2.253 . . . . 0.0 116.65 -171.811 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.65 HD12 HG21 ' A' ' 84' ' ' ILE . 54.7 mt -65.18 -59.15 4.41 Favored 'General case' 0 C--N 1.274 -2.678 0 C-N-CA 124.638 1.175 . . . . 0.0 110.847 172.916 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.417 ' HB3' ' HG ' ' A' ' 83' ' ' LEU . 36.4 m-20 -97.12 -39.18 9.43 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.709 -175.924 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' TYR . . . . . 0.63 ' O ' ' HA ' ' A' ' 86' ' ' GLU . 2.6 p90 -145.05 -164.34 1.91 Allowed 'General case' 0 C--O 1.162 -3.511 0 N-CA-C 105.172 -2.158 . . . . 0.0 105.172 -177.344 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.667 ' O ' ' HA ' ' A' ' 32' ' ' LEU . 3.1 mt -144.85 150.94 15.72 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.313 0 CA-C-N 120.25 1.386 . . . . 0.0 108.767 171.848 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.545 HD21 ' CD1' ' A' ' 32' ' ' LEU . 26.4 mt -119.98 117.98 29.47 Favored 'General case' 0 N--CA 1.393 -3.286 0 O-C-N 124.444 1.09 . . . . 0.0 110.936 175.829 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.513 ' HB3' ' HA3' ' A' ' 96' ' ' GLY . 1.2 mm? -111.95 161.14 27.15 Favored Pre-proline 0 CA--C 1.487 -1.48 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 177.334 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -59.78 168.22 5.87 Favored 'Trans proline' 0 C--O 1.257 1.432 0 C-N-CA 121.886 1.724 . . . . 0.0 108.158 165.246 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 34.1 m -50.89 -40.48 56.79 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 177.214 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.463 ' O ' ' HG2' ' A' ' 99' ' ' LYS . 6.3 mm-40 -57.12 -52.71 64.19 Favored 'General case' 0 C--O 1.198 -1.635 0 C-N-CA 124.021 0.929 . . . . 0.0 111.522 177.048 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.544 ' O ' HD22 ' A' ' 100' ' ' LEU . . . -54.23 -57.61 16.2 Favored Glycine 0 CA--C 1.495 -1.211 0 O-C-N 124.049 0.843 . . . . 0.0 112.082 -175.033 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 47.8 t-105 -53.66 -51.02 64.49 Favored 'General case' 0 C--N 1.289 -2.027 0 C-N-CA 123.512 0.725 . . . . 0.0 111.287 174.658 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -55.03 -28.79 54.9 Favored 'General case' 0 C--O 1.195 -1.782 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 175.464 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.644 ' HB3' ' CH2' ' A' ' 103' ' ' TRP . 19.0 mmtp -69.76 -57.14 5.47 Favored 'General case' 0 N--CA 1.41 -2.465 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 177.257 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.568 ' HB3' HD11 ' A' ' 65' ' ' ILE . 0.5 OUTLIER -58.88 -39.22 80.74 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.918 -176.94 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.523 ' O ' ' HA ' ' A' ' 105' ' ' THR . 55.2 t -75.6 -26.71 18.36 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.377 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.817 177.268 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 25.9 t -73.73 -39.08 64.53 Favored 'General case' 0 C--N 1.296 -1.725 0 O-C-N 120.96 -1.087 . . . . 0.0 108.583 176.138 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' TRP . . . . . 0.644 ' CH2' ' HB3' ' A' ' 99' ' ' LYS . 26.1 m0 -79.35 -49.51 12.29 Favored 'General case' 0 N--CA 1.437 -1.097 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.954 -174.369 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 64.5 m-85 -126.84 8.62 6.85 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 114.108 1.151 . . . . 0.0 114.108 -176.792 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.523 ' HA ' ' O ' ' A' ' 101' ' ' VAL 0.268 6.0 t 49.63 -174.58 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 126.608 1.963 . . . . 0.0 115.584 179.538 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -98.34 157.43 16.19 Favored 'General case' 0 C--N 1.247 -3.862 0 CA-C-N 112.733 -2.031 . . . . 0.0 107.45 -174.421 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 23.2 tpp -74.57 137.96 42.73 Favored 'General case' 1 N--CA 1.369 -4.475 0 CA-C-O 121.749 0.785 . . . . 0.0 109.311 175.372 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -63.35 123.49 18.83 Favored 'General case' 1 N--CA 1.362 -4.844 0 C-N-CA 126.188 1.795 . . . . 0.0 110.583 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 107.97 -15.25 37.12 Favored Glycine 0 N--CA 1.421 -2.31 0 CA-C-N 113.809 -1.541 . . . . 0.0 111.039 -177.772 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -104.02 156.74 17.61 Favored 'General case' 0 N--CA 1.434 -1.23 0 CA-C-O 121.885 0.85 . . . . 0.0 112.426 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -134.72 141.31 38.18 Favored Pre-proline 0 C--N 1.292 -1.919 0 N-CA-C 106.119 -1.808 . . . . 0.0 106.119 -177.82 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -48.73 125.34 12.57 Favored 'Trans proline' 0 CA--C 1.47 -2.684 0 C-N-CA 123.962 3.108 . . . . 0.0 115.263 -172.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.49 HG12 HD21 ' A' ' 71' ' ' LEU . 3.7 mp -90.73 109.22 20.64 Favored 'Isoleucine or valine' 1 N--CA 1.377 -4.092 0 CA-C-N 112.411 -2.177 . . . . 0.0 106.011 177.43 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -108.69 138.74 44.53 Favored 'General case' 0 C--N 1.281 -2.387 0 CA-C-O 121.927 0.87 . . . . 0.0 112.397 -177.546 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.563 ' HG3' HD11 ' A' ' 32' ' ' LEU . 11.8 mmm180 -120.57 -172.12 2.31 Favored 'General case' 0 C--N 1.282 -2.346 0 N-CA-C 104.126 -2.546 . . . . 0.0 104.126 173.031 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' LYS . . . . . 0.471 ' HA ' ' HA ' ' A' ' 29' ' ' THR . 24.4 pttm -135.48 -167.31 1.99 Allowed 'General case' 0 C--N 1.247 -3.871 0 N-CA-C 107.353 -1.351 . . . . 0.0 107.353 176.167 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.584 HG21 ' O ' ' A' ' 25' ' ' ARG . 59.4 t . . . . . 0 C--N 1.283 -2.291 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 171.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.509 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . . . . . . 0 N--CA 1.436 -1.148 0 CA-C-O 121.24 0.543 . . . . 0.0 111.307 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.51 ' O ' ' HB ' ' A' ' 11' ' ' THR . 21.2 t70 -74.7 149.25 39.95 Favored 'General case' 0 C--O 1.199 -1.57 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.378 178.246 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.41 ' HA ' ' HG3' ' A' ' 12' ' ' GLN . 18.7 mt -51.43 -38.53 54.08 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.635 0.774 . . . . 0.0 111.2 -177.47 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -67.51 -38.65 84.59 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-N 113.684 -1.598 . . . . 0.0 109.227 -176.706 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.51 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 8.2 m -74.05 -48.3 30.83 Favored 'General case' 0 N--CA 1.38 -3.929 0 CA-C-N 113.604 -1.634 . . . . 0.0 110.597 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.457 ' HB3' ' HZ2' ' A' ' 41' ' ' TRP . 14.5 mt-30 -52.51 -54.29 34.52 Favored 'General case' 0 CA--C 1.48 -1.721 0 O-C-N 123.903 0.752 . . . . 0.0 110.561 -174.688 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.664 ' HD3' HG21 ' A' ' 45' ' ' VAL . 4.0 mmm180 -70.6 -32.32 69.62 Favored 'General case' 0 CA--C 1.452 -2.797 0 N-CA-C 115.627 1.714 . . . . 0.0 115.627 -176.081 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 33.8 t -72.02 -45.54 60.5 Favored 'General case' 0 C--N 1.273 -2.72 0 O-C-N 123.971 0.794 . . . . 0.0 110.063 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -70.45 -31.41 68.57 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.927 -175.679 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.543 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 3.7 mm -80.88 -42.97 20.71 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.714 0 CA-C-N 115.297 -0.865 . . . . 0.0 112.222 176.606 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.531 ' O ' ' HG2' ' A' ' 21' ' ' LYS . . . -55.47 -37.29 67.6 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.473 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.484 ' HA ' ' HD3' ' A' ' 21' ' ' LYS . 1.2 m -63.1 -34.55 77.83 Favored 'General case' 0 N--CA 1.405 -2.718 0 CA-C-N 113.75 -1.568 . . . . 0.0 112.276 -179.284 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.419 HD11 ' HE3' ' A' ' 99' ' ' LYS . 82.9 mt -86.09 -14.03 45.48 Favored 'General case' 0 C--N 1.275 -2.643 0 O-C-N 121.694 -0.629 . . . . 0.0 112.305 -176.89 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 20.4 mt -84.11 -28.24 27.63 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 178.233 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.531 ' HG2' ' O ' ' A' ' 17' ' ' ALA . 19.2 ptmt -88.47 -23.35 23.27 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 114.705 -1.134 . . . . 0.0 110.945 -175.356 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.2 m -57.4 141.55 46.89 Favored 'General case' 0 N--CA 1.404 -2.761 0 C-N-CA 125.24 1.416 . . . . 0.0 111.233 173.658 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.3 m -87.33 170.11 11.69 Favored 'General case' 0 N--CA 1.403 -2.777 0 CA-C-N 114.027 -1.442 . . . . 0.0 111.969 -176.27 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.639 ' HB2' HG12 ' A' ' 117' ' ' VAL . 0.7 OUTLIER -112.78 163.91 14.02 Favored 'General case' 0 N--CA 1.408 -2.569 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 178.003 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 28.3 mmt180 -104.59 -159.55 0.72 Allowed 'General case' 0 C--N 1.297 -1.675 0 CA-C-N 114.514 -1.221 . . . . 0.0 108.186 176.135 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -109.64 18.72 19.98 Favored 'General case' 0 N--CA 1.42 -1.963 0 N-CA-C 106.808 -1.552 . . . . 0.0 106.808 175.615 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.485 ' N ' HG21 ' A' ' 117' ' ' VAL . . . -155.85 29.65 0.6 Allowed Glycine 0 N--CA 1.427 -1.959 0 CA-C-N 114.284 -1.326 . . . . 0.0 112.915 179.182 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.46 ' HB2' ' CG1' ' A' ' 117' ' ' VAL . 57.2 m-20 -95.69 153.36 17.77 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 119.189 -1.004 . . . . 0.0 109.6 176.223 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 98.9 m -104.99 129.21 53.48 Favored 'General case' 0 C--N 1.287 -2.122 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 174.614 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.532 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 40.9 m95 -116.51 139.11 50.83 Favored 'General case' 0 C--N 1.297 -1.696 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -178.772 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.436 ' HB2' ' HB2' ' A' ' 97' ' ' TRP . 72.3 m-85 -104.92 141.78 35.94 Favored 'General case' 0 C--N 1.276 -2.63 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.305 -176.013 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.504 HD11 ' HB2' ' A' ' 115' ' ' ARG . 6.0 mp -89.65 136.87 32.78 Favored 'General case' 0 CA--C 1.49 -1.344 0 O-C-N 124.383 1.052 . . . . 0.0 111.513 179.67 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.449 HG12 ' O ' ' A' ' 34' ' ' ASP . 81.7 t -121.74 140.36 45.98 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.868 0 N-CA-C 104.41 -2.441 . . . . 0.0 104.41 172.339 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.481 ' OD2' ' HB2' ' A' ' 36' ' ' ARG . 5.5 p-10 -69.69 127.38 32.76 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 106.153 -1.795 . . . . 0.0 106.153 172.157 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 69.6 p -67.37 -19.19 65.39 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-O 121.565 0.698 . . . . 0.0 110.899 -172.407 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.481 ' HB2' ' OD2' ' A' ' 34' ' ' ASP . 44.5 mtt180 -63.9 -48.06 78.14 Favored 'General case' 0 C--N 1.285 -2.235 0 C-N-CA 125.51 1.524 . . . . 0.0 108.29 -177.023 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.464 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 73.6 t90 -63.84 -48.09 78.18 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 124.597 1.159 . . . . 0.0 108.803 177.808 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.423 ' CG ' HD12 ' A' ' 90' ' ' ILE . 23.3 t80 -61.86 -40.04 93.95 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 114.858 -1.064 . . . . 0.0 111.614 -177.631 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -67.02 -34.36 77.56 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 175.649 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.464 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 6.0 tp-100 -65.55 -42.39 91.94 Favored 'General case' 0 N--CA 1.423 -1.796 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 175.068 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.647 ' O ' HG22 ' A' ' 45' ' ' VAL . 47.8 t90 -66.04 -37.81 86.79 Favored 'General case' 0 N--CA 1.436 -1.14 0 CA-C-N 114.256 -1.338 . . . . 0.0 110.036 179.805 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.0 mtpp -53.72 -45.52 70.5 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.746 0.818 . . . . 0.0 113.177 175.195 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.47 ' HG2' ' OD2' ' A' ' 51' ' ' ASP . 51.5 mttm -65.31 -46.25 81.07 Favored 'General case' 0 CA--C 1.507 -0.676 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 177.977 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.453 ' HB2' HG23 ' A' ' 60' ' ' VAL . 3.5 t80 -55.29 -33.09 62.93 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 114.306 -1.315 . . . . 0.0 113.539 -179.448 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.664 HG21 ' HD3' ' A' ' 13' ' ' ARG . 5.7 m -102.45 -11.75 8.92 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -179.392 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.456 ' HA2' ' HB2' ' A' ' 52' ' ' LYS . . . 71.71 43.41 51.56 Favored Glycine 0 N--CA 1.415 -2.707 0 C-N-CA 120.003 -1.094 . . . . 0.0 111.554 -175.445 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -66.77 -45.1 79.57 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 176.332 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -83.44 153.87 24.25 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 115.225 -0.898 . . . . 0.0 108.958 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 5.4 p -84.51 -48.8 9.22 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-O 121.227 0.536 . . . . 0.0 111.921 -179.263 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 46.6 p90 -73.67 -16.6 61.21 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.752 -177.587 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.47 ' OD2' ' HG2' ' A' ' 43' ' ' LYS . 30.7 t70 -135.37 87.34 2.32 Favored 'General case' 0 CA--C 1.474 -1.954 0 CA-C-O 121.956 0.884 . . . . 0.0 111.159 -174.6 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.456 ' HB2' ' HA2' ' A' ' 46' ' ' GLY . 64.7 pttt -157.5 15.47 0.25 Allowed 'General case' 0 N--CA 1.429 -1.483 0 CA-C-N 113.835 -1.53 . . . . 0.0 112.236 -176.305 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 87.5 m-85 -64.1 -10.0 19.82 Favored 'General case' 0 C--N 1.292 -1.927 0 CA-C-N 114.922 -1.036 . . . . 0.0 110.356 173.465 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.59 ' HB3' HG11 ' A' ' 60' ' ' VAL . 19.3 mm-40 -100.72 3.23 42.12 Favored 'General case' 0 N--CA 1.405 -2.724 0 C-N-CA 125.396 1.478 . . . . 0.0 110.753 -176.647 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' MET . . . . . 0.404 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 48.7 ttp -65.09 109.13 2.05 Favored 'General case' 0 N--CA 1.426 -1.631 0 CA-C-O 121.227 0.537 . . . . 0.0 111.818 -176.311 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 89.95 2.36 75.04 Favored Glycine 0 N--CA 1.429 -1.777 0 CA-C-N 114.357 -1.292 . . . . 0.0 111.756 -178.037 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.501 ' HB3' HG22 ' A' ' 60' ' ' VAL . 4.8 t70 -77.28 152.27 34.68 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 -177.662 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.45 ' O ' ' HD2' ' A' ' 61' ' ' TYR . 20.7 pt20 -84.15 -24.32 30.27 Favored 'General case' 0 C--N 1.292 -1.895 0 CA-C-O 121.609 0.719 . . . . 0.0 109.809 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -61.13 -21.1 63.42 Favored 'General case' 0 CA--C 1.498 -1.039 0 CA-C-N 115.351 -0.84 . . . . 0.0 112.015 -179.163 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.59 HG11 ' HB3' ' A' ' 54' ' ' GLN . 28.8 m -119.47 2.39 7.18 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.073 0 CA-C-N 115.19 -0.914 . . . . 0.0 112.359 -173.708 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.45 ' HD2' ' O ' ' A' ' 58' ' ' GLN . 0.9 OUTLIER -65.3 114.63 16.19 Favored Pre-proline 0 C--N 1.314 -0.978 0 O-C-N 124.121 0.888 . . . . 0.0 110.504 -177.552 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -89.86 113.33 0.53 Allowed 'Trans proline' 0 N--CA 1.419 -2.871 0 C-N-CA 122.491 2.128 . . . . 0.0 109.688 177.052 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -70.64 -140.05 0.18 Allowed Glycine 0 C--N 1.281 -2.514 0 CA-C-N 114.923 -1.035 . . . . 0.0 113.163 177.094 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.402 ' HA ' ' O ' ' A' ' 104' ' ' TYR . 11.8 Cg_endo -56.16 145.24 77.28 Favored 'Trans proline' 0 C--O 1.252 1.205 0 C-N-CA 122.67 2.247 . . . . 0.0 112.739 -178.2 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 60.9 mt -72.63 117.09 15.67 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.98 -178.71 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.597 ' HB2' ' HG3' ' A' ' 107' ' ' MET . 17.0 t0 -116.33 104.53 11.57 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-O 121.896 0.855 . . . . 0.0 111.384 178.389 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.664 ' O ' HD23 ' A' ' 71' ' ' LEU . 42.9 m-80 -92.91 5.86 49.86 Favored 'General case' 0 C--N 1.284 -2.245 0 CA-C-N 114.899 -1.046 . . . . 0.0 111.04 -178.621 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 19.2 t -72.74 83.89 1.18 Allowed 'General case' 0 N--CA 1.445 -0.676 0 CA-C-O 122.523 1.154 . . . . 0.0 107.899 177.3 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 169.25 -20.74 0.08 OUTLIER Glycine 0 N--CA 1.42 -2.414 0 N-CA-C 108.45 -1.86 . . . . 0.0 108.45 -175.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.427 HD22 ' HB3' ' A' ' 89' ' ' TYR . 79.2 mt -88.41 -29.53 20.16 Favored 'General case' 0 CA--C 1.484 -1.568 0 N-CA-C 104.667 -2.345 . . . . 0.0 104.667 171.532 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.664 HD23 ' O ' ' A' ' 67' ' ' ASN . 2.2 mm? -75.88 156.79 33.99 Favored 'General case' 0 N--CA 1.38 -3.959 0 CA-C-N 110.781 -2.918 . . . . 0.0 107.084 173.114 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.457 ' HG3' ' O ' ' A' ' 78' ' ' SER . 38.0 mtpt . . . . . 0 C--N 1.292 -1.892 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 -174.621 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.932 0 CA-C-O 121.147 0.499 . . . . 0.0 109.71 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 -116.9 -14.17 10.67 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-O 121.732 0.777 . . . . 0.0 110.175 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.457 ' O ' ' HG3' ' A' ' 72' ' ' LYS . 20.2 m -108.15 119.71 40.27 Favored 'General case' 0 C--N 1.299 -1.629 0 CA-C-N 114.81 -1.086 . . . . 0.0 110.845 -175.276 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.575 HD11 HG21 ' A' ' 113' ' ' ILE . 3.0 mm? -81.58 148.8 28.93 Favored 'General case' 0 N--CA 1.437 -1.087 0 C-N-CA 123.914 0.886 . . . . 0.0 111.986 -179.75 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -63.68 151.9 40.59 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.557 176.452 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -75.1 -35.83 61.72 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-O 122.145 0.974 . . . . 0.0 108.653 -178.176 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 15.4 t-80 -88.07 12.8 12.58 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-N 114.486 -1.234 . . . . 0.0 112.795 -170.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.434 ' HB3' ' CE2' ' A' ' 89' ' ' TYR . 43.2 mt -57.23 141.63 45.88 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 114.263 1.208 . . . . 0.0 114.263 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.808 HG21 HD12 ' A' ' 87' ' ' LEU . 62.8 mt -137.14 166.49 25.37 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 N-CA-C 106.251 -1.759 . . . . 0.0 106.251 -178.519 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.579 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 17.7 t70 -62.55 -146.22 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.213 0 C-N-CA 125.582 1.553 . . . . 0.0 110.586 -178.097 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.712 ' HA ' ' O ' ' A' ' 89' ' ' TYR 0.271 0.0 OUTLIER -40.74 -18.19 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.662 0 N-CA-C 117.014 2.228 . . . . 0.0 117.014 -174.029 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.808 HD12 HG21 ' A' ' 84' ' ' ILE . 44.4 mt -61.02 -61.03 2.87 Favored 'General case' 0 C--N 1.281 -2.411 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.838 170.113 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -97.83 -41.19 8.16 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 -176.585 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' TYR . . . . . 0.712 ' O ' ' HA ' ' A' ' 86' ' ' GLU . 1.3 p90 -139.9 -169.15 2.66 Favored 'General case' 0 C--O 1.155 -3.892 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.571 -174.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.474 ' O ' ' HA ' ' A' ' 32' ' ' LEU . 10.3 mt -146.21 153.01 13.41 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.343 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 170.801 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.405 ' N ' HG22 ' A' ' 90' ' ' ILE . 81.7 mt -117.73 134.69 54.65 Favored 'General case' 0 N--CA 1.413 -2.302 0 O-C-N 124.2 0.938 . . . . 0.0 110.907 177.14 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.435 HD12 ' N ' ' A' ' 92' ' ' LEU . 1.8 mp -140.2 159.53 63.53 Favored Pre-proline 0 C--N 1.291 -1.971 0 N-CA-C 106.794 -1.558 . . . . 0.0 106.794 -177.516 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -63.46 168.75 10.8 Favored 'Trans proline' 0 C--O 1.256 1.389 0 C-N-CA 121.992 1.795 . . . . 0.0 110.251 175.811 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.435 ' HA ' ' CE1' ' A' ' 31' ' ' TYR . 33.0 m -42.8 -47.95 5.59 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 124.532 1.145 . . . . 0.0 110.799 172.941 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -66.21 -38.15 87.26 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-N 114.613 -1.176 . . . . 0.0 112.33 -175.731 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.471 ' O ' ' HG ' ' A' ' 100' ' ' LEU . . . -62.18 -51.3 57.64 Favored Glycine 0 N--CA 1.429 -1.815 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 -179.278 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.436 ' HB2' ' HB2' ' A' ' 31' ' ' TYR . 69.1 t-105 -57.54 -50.04 74.38 Favored 'General case' 0 N--CA 1.428 -1.566 0 CA-C-N 114.594 -0.803 . . . . 0.0 110.35 174.617 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -48.26 -45.22 34.28 Favored 'General case' 0 CA--C 1.489 -1.368 0 O-C-N 123.788 0.68 . . . . 0.0 111.621 176.886 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.419 ' HE3' HD11 ' A' ' 19' ' ' LEU . 60.5 mttm -66.4 -45.27 80.55 Favored 'General case' 0 N--CA 1.426 -1.639 0 CA-C-O 120.639 0.257 . . . . 0.0 110.625 -177.213 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 96' ' ' GLY . 64.9 mt -65.1 -34.23 77.92 Favored 'General case' 0 C--N 1.292 -1.934 0 CA-C-O 121.403 0.62 . . . . 0.0 111.289 -178.929 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.51 ' HA ' ' HA ' ' A' ' 105' ' ' THR . 8.8 t -78.84 -23.8 13.0 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.456 0 CA-C-O 121.771 0.796 . . . . 0.0 111.12 176.594 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 67.1 m -73.51 -37.98 65.5 Favored 'General case' 0 N--CA 1.418 -2.031 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 174.648 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' TRP . . . . . 0.45 ' CH2' ' HA ' ' A' ' 12' ' ' GLN . 44.8 m0 -84.34 -42.44 15.75 Favored 'General case' 0 N--CA 1.424 -1.758 0 CA-C-N 114.995 -1.002 . . . . 0.0 112.959 -174.28 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' TYR . . . . . 0.402 ' O ' ' HA ' ' A' ' 64' ' ' PRO . 73.1 m-85 -127.63 -5.28 5.84 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 111.817 0.303 . . . . 0.0 111.817 -174.418 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.51 ' HA ' ' HA ' ' A' ' 101' ' ' VAL 0.288 13.7 t 50.62 -174.11 0.02 OUTLIER 'General case' 0 C--O 1.247 0.927 0 C-N-CA 125.788 1.635 . . . . 0.0 113.979 -173.69 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.425 ' HG ' ' N ' ' A' ' 107' ' ' MET . 37.1 tp -107.13 149.85 27.21 Favored 'General case' 0 C--N 1.244 -3.996 0 CA-C-N 113.305 -1.77 . . . . 0.0 109.057 -177.419 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' MET . . . . . 0.597 ' HG3' ' HB2' ' A' ' 66' ' ' ASP . 80.3 mmm -59.38 154.37 16.99 Favored 'General case' 0 CA--C 1.492 -1.267 0 CA-C-O 122.131 0.967 . . . . 0.0 111.039 173.236 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -76.57 140.31 41.02 Favored 'General case' 0 N--CA 1.396 -3.165 0 CA-C-N 114.468 -1.242 . . . . 0.0 111.322 -176.131 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 88.84 -25.9 9.15 Favored Glycine 0 N--CA 1.412 -2.904 0 CA-C-N 114.743 -1.117 . . . . 0.0 113.667 175.674 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -92.01 172.19 8.61 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 119.681 -0.808 . . . . 0.0 109.355 -177.148 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -121.67 158.33 54.46 Favored Pre-proline 0 N--CA 1.432 -1.352 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -177.299 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' PRO . . . . . 0.409 ' HB3' ' CE2' ' A' ' 97' ' ' TRP . 22.9 Cg_exo -67.79 122.39 9.54 Favored 'Trans proline' 0 CA--C 1.448 -3.792 0 C-N-CA 122.358 2.039 . . . . 0.0 109.174 169.965 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.575 HG21 HD11 ' A' ' 79' ' ' LEU . 3.3 mp -82.79 109.33 16.55 Favored 'Isoleucine or valine' 1 N--CA 1.375 -4.208 0 CA-C-N 114.322 -1.308 . . . . 0.0 108.057 -178.637 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -102.13 137.98 39.69 Favored 'General case' 0 C--N 1.277 -2.574 0 CA-C-N 115.472 -0.786 . . . . 0.0 109.975 179.667 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.504 ' HB2' HD11 ' A' ' 32' ' ' LEU . 5.7 tpt180 -135.34 -178.71 5.23 Favored 'General case' 0 N--CA 1.402 -2.857 0 N-CA-C 103.841 -2.651 . . . . 0.0 103.841 178.269 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -137.03 179.27 6.48 Favored 'General case' 0 N--CA 1.402 -2.87 0 C-N-CA 118.217 -1.393 . . . . 0.0 113.27 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.639 HG12 ' HB2' ' A' ' 24' ' ' LEU . 7.3 m . . . . . 0 N--CA 1.383 -3.793 0 CA-C-N 111.408 -2.633 . . . . 0.0 112.915 174.083 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.472 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . . . . . . 0 CA--C 1.502 -0.887 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.682 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 13.8 t70 -69.14 145.46 53.32 Favored 'General case' 0 CA--C 1.467 -2.213 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 177.611 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -40.75 -51.53 3.07 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 126.083 1.753 . . . . 0.0 112.579 178.043 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -76.07 -31.55 58.83 Favored 'General case' 0 C--N 1.276 -2.587 0 CA-C-N 113.638 -1.619 . . . . 0.0 110.771 -176.065 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.502 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 3.7 m -65.14 -46.29 81.54 Favored 'General case' 0 N--CA 1.4 -2.94 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 177.271 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.682 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 53.7 mt-30 -54.66 -44.14 73.0 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-N 114.848 -1.069 . . . . 0.0 109.413 -179.081 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.474 ' CG ' ' HB ' ' A' ' 45' ' ' VAL . 3.2 mmp_? -70.32 -41.4 73.32 Favored 'General case' 0 N--CA 1.411 -2.387 0 N-CA-C 113.412 0.894 . . . . 0.0 113.412 -178.472 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.2 m -64.36 -46.3 84.02 Favored 'General case' 0 C--N 1.251 -3.683 0 CA-C-O 121.414 0.626 . . . . 0.0 110.484 -178.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.477 ' O ' ' HB ' ' A' ' 18' ' ' THR . 51.3 t0 -67.72 -46.83 71.07 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 114.659 -1.155 . . . . 0.0 109.671 -177.75 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.662 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 21.6 mm -71.94 -39.39 66.82 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.58 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.993 -177.449 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.487 ' O ' ' HG2' ' A' ' 21' ' ' LYS . . . -58.61 -34.8 71.54 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 -179.829 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.522 ' HA ' ' HE2' ' A' ' 21' ' ' LYS . 2.9 m -66.94 -42.07 85.92 Favored 'General case' 0 N--CA 1.4 -2.943 0 CA-C-N 113.975 -1.466 . . . . 0.0 111.905 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.456 HD11 ' HE3' ' A' ' 99' ' ' LYS . 82.0 mt -78.77 -12.67 60.03 Favored 'General case' 0 C--N 1.268 -2.962 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -175.644 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.662 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 20.6 mt -82.17 -31.48 30.42 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.098 -0.705 . . . . 0.0 109.098 176.264 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.522 ' HE2' ' HA ' ' A' ' 18' ' ' THR . 48.2 pttt -92.69 -25.93 18.02 Favored 'General case' 0 N--CA 1.425 -1.723 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.439 -174.101 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 31.8 m -67.73 137.67 55.66 Favored 'General case' 0 N--CA 1.398 -3.045 0 CA-C-O 122.336 1.065 . . . . 0.0 112.089 177.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.456 ' HA ' HD13 ' A' ' 24' ' ' LEU . 36.8 t -94.77 167.68 11.29 Favored 'General case' 0 N--CA 1.391 -3.421 0 CA-C-N 112.928 -1.942 . . . . 0.0 109.306 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.514 ' N ' HD13 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -105.19 177.95 4.7 Favored 'General case' 1 N--CA 1.377 -4.101 0 CA-C-N 112.834 -1.985 . . . . 0.0 114.301 -167.267 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.64 ' O ' HG21 ' A' ' 117' ' ' VAL . 25.1 mmt180 -134.13 143.24 47.83 Favored 'General case' 0 C--N 1.285 -2.215 0 CA-C-N 112.643 -2.071 . . . . 0.0 106.834 175.866 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 44.0 mtpt -67.9 95.19 0.51 Allowed 'General case' 0 C--N 1.306 -1.319 0 CA-C-O 121.808 0.813 . . . . 0.0 109.596 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 143.37 19.52 0.22 Allowed Glycine 0 N--CA 1.426 -1.971 0 CA-C-N 114.17 -1.377 . . . . 0.0 110.554 -174.355 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.403 ' HB2' ' CG2' ' A' ' 117' ' ' VAL . 37.1 m-20 -103.58 -179.63 4.0 Favored 'General case' 0 CA--C 1.499 -1.008 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 176.402 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 86.1 m -140.97 127.3 19.79 Favored 'General case' 0 N--CA 1.42 -1.958 0 N-CA-C 106.576 -1.638 . . . . 0.0 106.576 176.015 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.465 ' CZ2' HD12 ' A' ' 24' ' ' LEU . 42.2 m95 -112.84 119.4 37.88 Favored 'General case' 0 C--N 1.301 -1.502 0 CA-C-O 121.021 0.439 . . . . 0.0 109.988 -177.172 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.456 ' HB2' ' HB2' ' A' ' 97' ' ' TRP . 86.5 m-85 -94.36 148.67 21.99 Favored 'General case' 0 C--N 1.277 -2.545 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.594 -176.154 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.561 ' HA ' ' O ' ' A' ' 90' ' ' ILE . 6.2 mp -98.1 139.72 33.49 Favored 'General case' 0 CA--C 1.475 -1.932 0 O-C-N 124.042 0.839 . . . . 0.0 111.008 178.567 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.401 ' HA ' ' OD1' ' A' ' 67' ' ' ASN . 59.4 t -118.44 138.68 48.37 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.878 0 N-CA-C 105.52 -2.03 . . . . 0.0 105.52 172.343 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.51 ' OD1' ' HG2' ' A' ' 36' ' ' ARG . 19.5 t0 -63.8 128.7 36.98 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 106.86 -1.533 . . . . 0.0 106.86 171.777 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 83.0 p -68.15 -27.12 66.15 Favored 'General case' 0 C--O 1.193 -1.91 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 -170.69 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.51 ' HG2' ' OD1' ' A' ' 34' ' ' ASP . 19.1 mmt180 -64.59 -39.34 93.55 Favored 'General case' 0 N--CA 1.433 -1.322 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.329 -175.774 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.481 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 66.8 t90 -68.41 -47.27 67.72 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 178.019 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.455 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 39.3 t80 -60.72 -39.71 89.63 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.422 -179.831 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.516 ' HA ' ' HE3' ' A' ' 42' ' ' LYS . 93.1 mttt -66.36 -32.29 73.59 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 122.819 0.448 . . . . 0.0 111.98 176.795 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.481 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 4.9 tp-100 -68.94 -42.02 77.29 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 174.104 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.641 ' O ' HG22 ' A' ' 45' ' ' VAL . 52.9 t90 -64.45 -37.27 86.96 Favored 'General case' 0 N--CA 1.428 -1.574 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.685 177.165 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.516 ' HE3' ' HA ' ' A' ' 39' ' ' LYS . 7.2 mtmp? -51.37 -47.78 62.71 Favored 'General case' 0 C--N 1.369 1.424 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 175.222 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.47 ' HB3' ' HB2' ' A' ' 54' ' ' GLN . 63.3 mttm -55.03 -50.42 69.1 Favored 'General case' 0 CA--C 1.499 -1.009 0 O-C-N 124.178 0.924 . . . . 0.0 109.938 177.824 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.536 ' O ' ' HA ' ' A' ' 55' ' ' MET . 5.1 t80 -60.09 -38.99 84.55 Favored 'General case' 0 C--N 1.309 -1.152 0 CA-C-N 114.032 -1.44 . . . . 0.0 113.605 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.641 HG22 ' O ' ' A' ' 41' ' ' TRP . 0.2 OUTLIER -91.2 -30.04 4.8 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.519 0 N-CA-C 114.39 1.255 . . . . 0.0 114.39 -179.516 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.652 ' HA2' ' CB ' ' A' ' 52' ' ' LYS . . . 87.92 34.76 9.62 Favored Glycine 0 N--CA 1.4 -3.742 0 C-N-CA 120.229 -0.986 . . . . 0.0 112.69 -176.334 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.47 ' CD1' ' CZ ' ' A' ' 13' ' ' ARG . 89.9 t80 -60.7 -49.81 76.0 Favored 'General case' 0 CA--C 1.508 -0.672 0 CA-C-O 121.814 0.816 . . . . 0.0 110.257 177.502 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.525 ' HB3' ' HB3' ' A' ' 51' ' ' ASP . 1.5 t0 -81.94 -176.65 6.23 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 114.123 -1.399 . . . . 0.0 110.717 -168.257 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' SER . . . . . 0.416 ' O ' ' HE2' ' A' ' 52' ' ' LYS . 16.9 m -91.68 -42.96 9.88 Favored 'General case' 0 C--N 1.292 -1.927 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.625 -177.333 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.483 ' CE2' ' HB2' ' A' ' 51' ' ' ASP . 64.8 p-90 -101.29 -20.17 15.34 Favored 'General case' 0 N--CA 1.395 -3.187 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 -176.664 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.525 ' HB3' ' HB3' ' A' ' 48' ' ' ASP . 31.0 t70 -103.37 78.62 1.63 Allowed 'General case' 0 CA--C 1.459 -2.548 0 CA-C-N 114.07 -1.423 . . . . 0.0 109.057 -169.343 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.652 ' CB ' ' HA2' ' A' ' 46' ' ' GLY . 65.5 pttt -169.92 3.55 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.429 0 CA-C-N 113.632 -1.622 . . . . 0.0 114.829 -174.322 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -64.6 -9.59 20.46 Favored 'General case' 0 C--N 1.299 -1.598 0 CA-C-O 121.561 0.696 . . . . 0.0 110.898 175.647 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.47 ' HB2' ' HB3' ' A' ' 43' ' ' LYS . 9.6 mm-40 -106.62 19.32 20.66 Favored 'General case' 0 N--CA 1.416 -2.147 0 C-N-CA 124.344 1.058 . . . . 0.0 109.832 -176.319 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' MET . . . . . 0.536 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 48.8 ttm -58.69 109.17 0.75 Allowed 'General case' 0 N--CA 1.424 -1.768 0 CA-C-O 121.444 0.64 . . . . 0.0 111.335 -178.765 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.91 23.9 75.31 Favored Glycine 0 N--CA 1.439 -1.131 0 CA-C-N 115.177 -0.92 . . . . 0.0 112.195 -178.643 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -95.04 151.88 18.8 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-O 121.115 0.483 . . . . 0.0 110.786 -175.865 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -83.69 -21.33 32.4 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.103 -178.777 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -63.51 -18.86 64.25 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.03 -0.986 . . . . 0.0 111.918 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 12.7 m -115.24 -9.12 12.3 Favored 'Isoleucine or valine' 0 CA--C 1.443 -3.172 0 CA-C-O 118.327 -0.844 . . . . 0.0 112.834 -178.524 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 1.6 p90 -34.34 100.47 0.19 Allowed Pre-proline 0 CA--C 1.557 1.219 0 O-C-N 126.3 2.25 . . . . 0.0 114.181 -163.802 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -78.29 102.46 1.57 Allowed 'Trans proline' 0 N--CA 1.425 -2.543 0 C-N-CA 122.797 2.331 . . . . 0.0 109.777 174.828 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -82.01 -146.87 5.91 Favored Glycine 0 C--N 1.295 -1.715 0 CA-C-N 114.29 -1.323 . . . . 0.0 111.629 177.956 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.454 ' HA ' ' O ' ' A' ' 104' ' ' TYR . 86.8 Cg_exo -50.23 133.92 36.68 Favored 'Trans proline' 0 C--O 1.238 0.492 0 C-N-CA 123.763 2.975 . . . . 0.0 113.82 178.747 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.603 HD11 ' HB3' ' A' ' 100' ' ' LEU . 45.2 mt -68.53 115.12 6.25 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 CA-C-N 114.764 -1.107 . . . . 0.0 111.437 -176.07 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -110.82 121.24 44.85 Favored 'General case' 0 C--N 1.289 -2.033 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 173.241 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.401 ' OD1' ' HA ' ' A' ' 33' ' ' VAL . 38.5 m-80 -109.03 18.47 20.6 Favored 'General case' 0 C--N 1.306 -1.3 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.725 -176.833 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 10.0 t -68.8 -2.7 10.08 Favored 'General case' 0 CA--C 1.552 1.039 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -176.471 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -83.74 -19.88 60.81 Favored Glycine 0 N--CA 1.441 -1.011 0 N-CA-C 111.607 -0.597 . . . . 0.0 111.607 176.297 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 64.7 mt -91.09 -25.89 19.4 Favored 'General case' 0 CA--C 1.499 -1.018 0 CA-C-O 121.79 0.805 . . . . 0.0 109.699 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 50.1 mt -71.36 129.48 38.93 Favored 'General case' 0 N--CA 1.421 -1.876 0 CA-C-N 114.087 -1.415 . . . . 0.0 110.892 -173.018 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 73.2 tttt . . . . . 0 N--CA 1.402 -2.867 0 CA-C-N 114.483 -1.235 . . . . 0.0 109.824 -178.766 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.463 0 CA-C-O 121.88 0.848 . . . . 0.0 110.567 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 20.8 mm-40 -112.41 -3.21 14.53 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-O 122.414 1.102 . . . . 0.0 108.221 178.162 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 68.0 m -100.74 137.45 39.12 Favored 'General case' 0 C--N 1.284 -2.252 0 CA-C-N 113.481 -1.69 . . . . 0.0 109.586 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.576 HD21 HG21 ' A' ' 113' ' ' ILE . 96.6 mt -106.94 153.02 23.16 Favored 'General case' 0 C--N 1.296 -1.718 0 CA-C-O 120.953 0.406 . . . . 0.0 111.402 -178.974 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.417 ' HB2' ' HG ' ' A' ' 83' ' ' LEU . 67.9 mttm -65.14 153.09 41.89 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.28 175.069 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -77.0 -33.84 57.55 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 114.581 1.326 . . . . 0.0 114.581 -169.308 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 19.5 t-80 -98.35 11.76 37.02 Favored 'General case' 0 C--N 1.298 -1.658 0 CA-C-O 120.696 0.284 . . . . 0.0 111.726 -172.49 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.417 ' HG ' ' HB2' ' A' ' 80' ' ' LYS . 83.2 mt -66.36 118.63 10.29 Favored 'General case' 0 C--N 1.307 -1.259 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -176.693 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.563 HG21 HD12 ' A' ' 87' ' ' LEU . 44.8 mm -92.56 170.43 1.23 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 N-CA-C 106.674 -1.602 . . . . 0.0 106.674 175.398 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.654 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 22.4 t70 -60.62 -130.53 0.0 OUTLIER 'General case' 0 CA--C 1.577 2.011 0 C-N-CA 125.472 1.509 . . . . 0.0 112.403 -177.589 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.703 ' HA ' ' O ' ' A' ' 89' ' ' TYR . 9.6 pt-20 -47.51 -17.39 0.09 Allowed 'General case' 0 N--CA 1.5 2.075 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 -176.963 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.563 HD12 HG21 ' A' ' 84' ' ' ILE . 11.8 mt -67.65 -54.22 21.43 Favored 'General case' 0 C--N 1.29 -2.005 0 CA-C-N 115.201 -0.909 . . . . 0.0 110.394 176.201 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -101.48 -33.8 9.81 Favored 'General case' 0 CA--C 1.499 -0.989 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.136 -178.333 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' TYR . . . . . 0.703 ' O ' ' HA ' ' A' ' 86' ' ' GLU . 4.8 p90 -141.11 -160.61 1.1 Allowed 'General case' 0 C--O 1.183 -2.398 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 -179.188 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.561 ' O ' ' HA ' ' A' ' 32' ' ' LEU . 1.2 mm -141.19 145.43 24.98 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.879 0 N-CA-C 106.908 -1.515 . . . . 0.0 106.908 172.24 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.49 HD23 ' HA ' ' A' ' 91' ' ' LEU . 58.2 mt -116.93 123.9 48.09 Favored 'General case' 0 N--CA 1.42 -1.967 0 CA-C-O 121.784 0.802 . . . . 0.0 111.122 171.035 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.55 HD11 ' HB ' ' A' ' 90' ' ' ILE . 1.0 OUTLIER -137.07 155.38 76.15 Favored Pre-proline 0 C--N 1.289 -2.049 0 CA-C-N 114.171 -1.377 . . . . 0.0 108.526 -175.493 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -61.56 169.24 7.06 Favored 'Trans proline' 0 C--O 1.255 1.338 0 C-N-CA 123.213 2.609 . . . . 0.0 110.786 176.337 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 32.3 m -47.17 -43.28 21.04 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 123.96 0.788 . . . . 0.0 109.406 173.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.536 ' HB3' ' HE2' ' A' ' 99' ' ' LYS . 9.2 mm-40 -56.28 -51.26 68.81 Favored 'General case' 0 C--O 1.196 -1.73 0 C-N-CA 124.422 1.089 . . . . 0.0 111.079 178.266 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.561 ' O ' HD22 ' A' ' 100' ' ' LEU . . . -50.87 -62.11 5.56 Favored Glycine 0 CA--C 1.497 -1.085 0 O-C-N 124.322 1.014 . . . . 0.0 111.567 -177.6 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.456 ' HB2' ' HB2' ' A' ' 31' ' ' TYR . 68.5 t-105 -53.5 -50.79 64.65 Favored 'General case' 0 C--N 1.309 -1.152 0 C-N-CA 123.696 0.799 . . . . 0.0 110.905 177.69 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -52.2 -34.57 46.08 Favored 'General case' 0 C--O 1.207 -1.148 0 O-C-N 123.562 0.539 . . . . 0.0 112.118 177.058 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.536 ' HE2' ' HB3' ' A' ' 95' ' ' GLU . 50.8 mttm -75.01 -51.67 13.01 Favored 'General case' 0 N--CA 1.412 -2.358 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.603 ' HB3' HD11 ' A' ' 65' ' ' ILE . 0.7 OUTLIER -58.95 -39.79 82.71 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.379 0.609 . . . . 0.0 111.534 -179.041 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.433 ' O ' ' HA ' ' A' ' 105' ' ' THR . 20.5 t -73.51 -31.08 31.63 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.172 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.851 177.559 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 37.5 t -73.91 -35.09 64.6 Favored 'General case' 0 C--N 1.314 -0.972 0 O-C-N 121.535 -0.728 . . . . 0.0 109.036 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' TRP . . . . . 0.442 ' CH2' ' HA ' ' A' ' 12' ' ' GLN . 49.4 m0 -78.24 -50.2 12.33 Favored 'General case' 0 N--CA 1.421 -1.924 0 CA-C-N 114.773 -1.103 . . . . 0.0 112.031 -176.731 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' TYR . . . . . 0.454 ' O ' ' HA ' ' A' ' 64' ' ' PRO . 55.2 m-85 -128.9 10.16 5.92 Favored 'General case' 0 CA--C 1.505 -0.764 0 N-CA-C 114.498 1.296 . . . . 0.0 114.498 -172.89 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.433 ' HA ' ' O ' ' A' ' 101' ' ' VAL 0.274 7.2 p 56.33 174.63 0.04 OUTLIER 'General case' 0 N--CA 1.418 -2.038 0 N-CA-C 117.025 2.231 . . . . 0.0 117.025 179.164 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.496 ' HG ' ' N ' ' A' ' 107' ' ' MET . 28.6 tp -104.93 161.59 14.07 Favored 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 114.57 -1.196 . . . . 0.0 108.487 -179.12 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' MET . . . . . 0.496 ' N ' ' HG ' ' A' ' 106' ' ' LEU . 24.4 tpp -72.19 141.06 49.04 Favored 'General case' 0 N--CA 1.38 -3.967 0 CA-C-O 122.047 0.927 . . . . 0.0 109.241 173.26 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . 0.276 6.7 tp10 -74.99 125.87 29.81 Favored 'General case' 1 N--CA 1.346 -5.625 0 CA-C-N 113.504 -1.68 . . . . 0.0 110.181 -174.547 . . . . . . . . 3 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 104.22 -6.25 46.31 Favored Glycine 0 N--CA 1.412 -2.959 0 CA-C-N 114.589 -1.187 . . . . 0.0 112.661 177.508 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.443 HE21 ' HB3' ' A' ' 110' ' ' GLN . 2.3 pt20 -109.34 158.08 18.25 Favored 'General case' 0 CA--C 1.494 -1.207 0 C-N-CA 117.936 -1.505 . . . . 0.0 109.805 177.252 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -122.39 133.47 24.4 Favored Pre-proline 0 C--N 1.286 -2.187 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -177.027 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -41.66 133.59 3.73 Favored 'Trans proline' 0 CA--C 1.477 -2.372 0 C-N-CA 124.687 3.591 . . . . 0.0 114.671 -177.201 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.576 HG21 HD21 ' A' ' 79' ' ' LEU . 3.6 mp -96.34 108.74 21.71 Favored 'Isoleucine or valine' 0 N--CA 1.385 -3.709 0 CA-C-N 113.053 -1.885 . . . . 0.0 107.007 179.437 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -113.72 147.89 37.4 Favored 'General case' 0 C--N 1.283 -2.283 0 CA-C-O 122.072 0.939 . . . . 0.0 113.024 -176.749 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.506 ' HG2' HD11 ' A' ' 32' ' ' LEU . 3.0 mmp_? -127.02 177.62 6.52 Favored 'General case' 0 CA--C 1.476 -1.867 0 N-CA-C 105.537 -2.023 . . . . 0.0 105.537 174.002 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -134.22 166.75 22.07 Favored 'General case' 0 C--N 1.258 -3.39 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.64 HG21 ' O ' ' A' ' 25' ' ' ARG . 59.8 t . . . . . 0 C--N 1.308 -1.222 0 CA-C-O 122.493 1.139 . . . . 0.0 111.386 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.454 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . . . . . . 0 CA--C 1.495 -1.162 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.611 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 12.5 t70 -68.24 144.3 54.95 Favored 'General case' 0 C--N 1.291 -1.961 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 173.373 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.479 ' O ' ' HG3' ' A' ' 13' ' ' ARG . 3.1 mm? -43.63 -53.12 5.94 Favored 'General case' 0 C--N 1.298 -1.662 0 C-N-CA 125.906 1.682 . . . . 0.0 112.67 177.802 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -67.9 -34.49 76.73 Favored 'General case' 0 C--N 1.276 -2.604 0 CA-C-N 114.61 -1.177 . . . . 0.0 110.293 -177.596 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.467 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 2.9 m -66.44 -46.66 75.73 Favored 'General case' 0 N--CA 1.384 -3.747 0 CA-C-N 114.99 -1.005 . . . . 0.0 110.522 178.042 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.611 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 71.0 mt-30 -56.1 -53.82 52.46 Favored 'General case' 0 N--CA 1.444 -0.758 0 O-C-N 123.548 0.53 . . . . 0.0 110.577 -177.581 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.524 ' HG2' HG13 ' A' ' 45' ' ' VAL . 59.2 mtt180 -46.64 -58.57 3.7 Favored 'General case' 0 N--CA 1.487 1.381 0 CA-C-O 122.432 1.11 . . . . 0.0 109.798 177.208 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 54.7 m -66.89 -45.49 77.86 Favored 'General case' 0 C--N 1.295 -1.787 0 CA-C-N 113.068 -1.878 . . . . 0.0 113.306 -170.442 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -67.82 -32.38 72.89 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.51 -175.188 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.536 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 27.7 mm -82.5 -38.29 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.142 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.274 177.106 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.07 -34.95 72.55 Favored 'General case' 0 CA--C 1.501 -0.941 0 CA-C-O 122.027 0.917 . . . . 0.0 108.73 179.016 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.452 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 2.6 m -64.81 -33.88 77.04 Favored 'General case' 0 N--CA 1.401 -2.912 0 CA-C-N 113.656 -1.611 . . . . 0.0 111.299 177.792 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.611 ' HB3' ' CG ' ' A' ' 93' ' ' PRO . 89.7 mt -85.94 -12.97 49.12 Favored 'General case' 0 C--N 1.267 -3.003 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -176.454 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.536 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 11.6 mt -86.43 -21.63 26.99 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 176.954 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.452 ' HE3' ' HA ' ' A' ' 18' ' ' THR . 0.0 OUTLIER -97.75 -4.44 37.06 Favored 'General case' 0 N--CA 1.426 -1.649 0 CA-C-N 114.537 -1.21 . . . . 0.0 111.333 -174.649 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.52 ' OG1' ' HA ' ' A' ' 19' ' ' LEU . 52.8 m -54.59 134.5 46.72 Favored 'General case' 0 N--CA 1.398 -3.075 0 C-N-CA 126.291 1.836 . . . . 0.0 111.351 173.323 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 68.3 m -70.48 132.64 45.87 Favored 'General case' 0 N--CA 1.387 -3.592 0 CA-C-N 113.405 -1.725 . . . . 0.0 111.338 179.121 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.49 HD22 HG13 ' A' ' 117' ' ' VAL . 1.7 pp -110.68 159.43 17.6 Favored 'General case' 0 N--CA 1.411 -2.408 0 CA-C-N 115.353 -0.84 . . . . 0.0 112.592 179.021 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.694 ' O ' HG11 ' A' ' 117' ' ' VAL . 19.9 mmt180 -105.51 -144.68 0.38 Allowed 'General case' 0 C--N 1.271 -2.821 0 N-CA-C 103.727 -2.694 . . . . 0.0 103.727 177.684 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.401 ' HA ' ' HB ' ' A' ' 117' ' ' VAL . 17.6 ptpt -128.91 14.93 6.36 Favored 'General case' 0 C--N 1.283 -2.323 0 CA-C-O 122.108 0.956 . . . . 0.0 109.868 166.952 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -130.89 20.53 4.8 Favored Glycine 0 N--CA 1.429 -1.803 0 CA-C-N 114.149 -1.387 . . . . 0.0 112.474 -179.632 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 45.0 m-20 -91.03 169.61 10.73 Favored 'General case' 0 CA--C 1.492 -1.258 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 177.419 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.512 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 85.1 m -118.67 130.68 55.98 Favored 'General case' 0 N--CA 1.409 -2.512 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 175.72 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.437 ' CZ2' HD23 ' A' ' 24' ' ' LEU . 33.4 m95 -114.7 155.98 25.63 Favored 'General case' 0 C--N 1.284 -2.277 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 177.008 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.546 ' HB2' ' HB2' ' A' ' 97' ' ' TRP . 84.9 m-85 -111.25 129.83 55.85 Favored 'General case' 0 C--N 1.264 -3.152 0 CA-C-O 121.04 0.448 . . . . 0.0 110.055 -178.973 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.8 HD11 ' CG ' ' A' ' 89' ' ' TYR . 26.3 tp -86.84 138.96 31.14 Favored 'General case' 1 N--CA 1.376 -4.17 0 N-CA-C 114.374 1.249 . . . . 0.0 114.374 -174.841 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.511 HG12 ' O ' ' A' ' 34' ' ' ASP . 46.3 t -132.85 154.04 39.02 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.465 0 C-N-CA 126.498 1.919 . . . . 0.0 107.821 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.522 ' CA ' HD21 ' A' ' 70' ' ' LEU . 23.0 t70 -71.09 144.11 50.42 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 173.299 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.456 ' HA ' HG13 ' A' ' 90' ' ' ILE . 50.2 p -71.98 -35.65 69.57 Favored 'General case' 0 C--N 1.277 -2.578 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.337 -171.699 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 17.0 mmm180 -80.75 -26.53 37.25 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 120.356 -0.538 . . . . 0.0 109.705 -174.678 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.489 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 67.1 t90 -65.99 -46.89 76.4 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 107.622 -1.251 . . . . 0.0 107.622 177.348 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.507 ' CG ' HD12 ' A' ' 90' ' ' ILE . 33.8 t80 -65.89 -37.65 86.67 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.329 179.488 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.477 ' HA ' ' HD3' ' A' ' 42' ' ' LYS . 94.6 mttt -67.03 -29.76 69.66 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 176.169 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.489 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 5.5 tp-100 -66.78 -45.91 76.97 Favored 'General case' 0 N--CA 1.406 -2.67 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 173.007 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 67.4 t90 -59.83 -41.54 91.55 Favored 'General case' 0 C--O 1.213 -0.828 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.649 176.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.538 ' HG2' ' CD1' ' A' ' 47' ' ' PHE . 15.2 mtpp -56.73 -38.19 72.04 Favored 'General case' 0 N--CA 1.44 -0.947 0 C-N-CA 123.252 0.621 . . . . 0.0 112.298 -179.469 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 44.1 mttp -76.54 -37.95 55.84 Favored 'General case' 0 C--N 1.281 -2.391 0 CA-C-N 116.004 -0.543 . . . . 0.0 112.251 178.589 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.632 ' HB2' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -69.03 -35.57 76.76 Favored 'General case' 0 N--CA 1.412 -2.343 0 CA-C-N 114.857 -1.065 . . . . 0.0 109.59 -179.746 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.524 HG13 ' HG2' ' A' ' 13' ' ' ARG . 2.5 p -89.93 -22.28 6.46 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.654 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -177.223 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.481 ' HA2' ' CB ' ' A' ' 52' ' ' LYS . . . 87.67 28.84 23.01 Favored Glycine 0 N--CA 1.435 -1.41 0 C-N-CA 121.122 -0.561 . . . . 0.0 112.446 -174.269 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.538 ' CD1' ' HG2' ' A' ' 42' ' ' LYS . 32.7 t80 -77.44 -35.67 53.74 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 177.703 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.472 ' HB2' ' O ' ' A' ' 51' ' ' ASP . 26.6 m-20 -76.76 103.48 6.74 Favored 'General case' 0 CA--C 1.491 -1.315 0 N-CA-C 106.061 -1.829 . . . . 0.0 106.061 172.596 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 9.2 m -54.61 -32.18 58.36 Favored 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 -176.546 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 45.7 p90 -95.5 -9.32 32.82 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.26 -178.835 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.472 ' O ' ' HB2' ' A' ' 48' ' ' ASP . 17.5 t0 -139.94 83.85 1.94 Allowed 'General case' 0 CA--C 1.487 -1.447 0 CA-C-O 122.398 1.094 . . . . 0.0 109.27 -175.349 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.481 ' CB ' ' HA2' ' A' ' 46' ' ' GLY . 55.4 pttt -145.93 16.31 1.39 Allowed 'General case' 0 N--CA 1.409 -2.504 0 CA-C-N 113.819 -1.537 . . . . 0.0 111.226 -173.828 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 19.9 p90 -69.11 -7.53 36.96 Favored 'General case' 0 C--N 1.285 -2.212 0 CA-C-N 114.589 -1.187 . . . . 0.0 111.115 173.117 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -102.75 12.0 36.85 Favored 'General case' 0 N--CA 1.41 -2.454 0 CA-C-N 114.591 -1.186 . . . . 0.0 109.679 -178.683 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' MET . . . . . 0.574 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 33.1 ttm -60.49 113.84 2.64 Favored 'General case' 0 N--CA 1.422 -1.835 0 CA-C-O 121.698 0.761 . . . . 0.0 111.898 -179.594 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 74.25 18.87 79.87 Favored Glycine 0 N--CA 1.431 -1.69 0 CA-C-N 114.736 -1.12 . . . . 0.0 111.558 -178.478 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.6 ' HB3' HG22 ' A' ' 60' ' ' VAL . 4.5 t0 -88.13 145.45 25.92 Favored 'General case' 0 CA--C 1.493 -1.215 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 -177.773 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.442 ' O ' ' HD1' ' A' ' 61' ' ' TYR . 11.5 pt20 -83.8 -8.66 59.18 Favored 'General case' 0 C--N 1.283 -2.313 0 CA-C-O 122.329 1.062 . . . . 0.0 110.535 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -72.99 -20.42 61.02 Favored 'General case' 0 C--N 1.288 -2.092 0 CA-C-N 114.419 -1.264 . . . . 0.0 111.003 173.539 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.632 HG23 ' HB2' ' A' ' 44' ' ' TYR . 35.4 m -128.1 7.9 3.07 Favored 'Isoleucine or valine' 0 CA--C 1.478 -1.805 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.375 -175.229 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.456 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 2.8 p90 -63.8 115.73 21.11 Favored Pre-proline 0 C--N 1.299 -1.593 0 O-C-N 124.098 0.874 . . . . 0.0 109.39 179.492 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' A' ' 61' ' ' TYR . 9.3 Cg_endo -87.19 111.86 0.87 Allowed 'Trans proline' 0 N--CA 1.417 -2.972 0 C-N-CA 122.37 2.046 . . . . 0.0 109.562 178.721 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -67.98 -147.19 0.14 Allowed Glycine 0 C--N 1.287 -2.162 0 CA-C-N 114.94 -1.027 . . . . 0.0 112.69 176.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -57.76 136.49 75.77 Favored 'Trans proline' 0 C--O 1.249 1.065 0 C-N-CA 122.101 1.868 . . . . 0.0 112.315 -177.151 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.482 HG12 ' CZ2' ' A' ' 37' ' ' TRP . 61.1 mt -62.79 110.17 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.074 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.912 -177.652 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -102.85 118.65 37.3 Favored 'General case' 0 C--N 1.299 -1.617 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.719 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -94.87 17.88 12.9 Favored 'General case' 0 C--N 1.296 -1.721 0 CA-C-N 115.71 -0.677 . . . . 0.0 112.615 179.544 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 19.4 m -79.67 24.57 0.37 Allowed 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 -176.905 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.445 ' H ' HD22 ' A' ' 70' ' ' LEU . . . -111.94 -21.7 6.24 Favored Glycine 0 CA--C 1.496 -1.104 0 N-CA-C 108.702 -1.759 . . . . 0.0 108.702 175.483 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.645 HD12 ' HB3' ' A' ' 89' ' ' TYR . 0.2 OUTLIER -102.72 -42.36 5.91 Favored 'General case' 0 N--CA 1.423 -1.791 0 CA-C-N 113.006 -1.597 . . . . 0.0 108.376 -173.45 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.55 HD13 ' HA ' ' A' ' 76' ' ' ALA . 91.2 mt -65.91 150.54 48.46 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-N 113.926 -1.488 . . . . 0.0 109.229 174.37 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt . . . . . 0 C--N 1.296 -1.758 0 CA-C-O 122.049 0.928 . . . . 0.0 111.471 -176.24 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.55 ' HA ' HD13 ' A' ' 71' ' ' LEU . . . . . . . . 0 CA--C 1.513 -0.449 0 CA-C-O 122.079 0.942 . . . . 0.0 110.301 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 20.1 mm-40 -120.45 5.91 10.64 Favored 'General case' 0 C--N 1.282 -2.339 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 53.9 m -119.39 124.29 46.22 Favored 'General case' 0 C--N 1.281 -2.408 0 CA-C-N 114.381 -1.282 . . . . 0.0 112.771 -173.896 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.411 HD21 HG21 ' A' ' 113' ' ' ILE . 82.6 mt -92.05 150.09 21.16 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.438 178.011 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.404 ' HB2' ' HG ' ' A' ' 83' ' ' LEU . 99.8 mttt -71.02 151.84 44.18 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.148 178.091 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -78.03 -23.54 48.16 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.798 -177.638 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 31.7 m170 -88.32 4.77 44.88 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -175.813 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.438 ' HB3' ' CE2' ' A' ' 89' ' ' TYR . 98.1 mt -65.71 133.38 50.94 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 114.497 1.295 . . . . 0.0 114.497 -173.79 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.736 HG21 HD12 ' A' ' 87' ' ' LEU . 43.0 mm -115.13 -178.91 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.086 0 N-CA-C 104.977 -2.231 . . . . 0.0 104.977 172.016 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.576 ' H ' HG22 ' A' ' 84' ' ' ILE . 21.7 t70 -71.54 -134.53 0.01 OUTLIER 'General case' 0 CA--C 1.57 1.724 0 CA-C-O 117.515 -1.231 . . . . 0.0 110.564 -178.074 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.674 ' HA ' ' O ' ' A' ' 89' ' ' TYR . 3.0 pp20? -45.53 -19.41 0.05 OUTLIER 'General case' 0 N--CA 1.51 2.543 0 N-CA-C 116.117 1.895 . . . . 0.0 116.117 -174.699 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.736 HD12 HG21 ' A' ' 84' ' ' ILE . 23.4 mt -59.76 -50.44 73.84 Favored 'General case' 0 C--N 1.287 -2.138 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.467 172.64 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -101.53 -50.01 3.86 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-N 114.753 -1.112 . . . . 0.0 111.342 -178.42 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' TYR . . . . . 0.8 ' CG ' HD11 ' A' ' 32' ' ' LEU . 0.5 OUTLIER -141.16 -175.7 4.42 Favored 'General case' 0 C--O 1.163 -3.472 0 C-N-CA 122.885 0.474 . . . . 0.0 110.968 -175.04 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.516 ' O ' HD12 ' A' ' 32' ' ' LEU . 7.1 mt -142.24 145.79 23.31 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.499 0 CA-C-N 118.943 0.792 . . . . 0.0 109.49 173.098 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.455 HD23 ' HA ' ' A' ' 91' ' ' LEU . 62.7 mt -109.72 133.58 52.96 Favored 'General case' 0 N--CA 1.405 -2.715 0 CA-C-N 114.662 -1.154 . . . . 0.0 111.841 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.402 HD22 ' N ' ' A' ' 92' ' ' LEU . 1.4 mm? -123.98 151.16 64.62 Favored Pre-proline 0 C--N 1.282 -2.332 0 CA-C-N 113.557 -1.656 . . . . 0.0 106.947 -177.57 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.611 ' CG ' ' HB3' ' A' ' 19' ' ' LEU . 11.1 Cg_endo -65.9 169.18 13.74 Favored 'Trans proline' 0 N--CA 1.443 -1.478 0 C-N-CA 121.937 1.758 . . . . 0.0 109.122 170.149 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 21.7 m -43.98 -48.35 8.66 Favored 'General case' 0 C--N 1.315 -0.917 0 O-C-N 123.518 0.512 . . . . 0.0 111.467 174.571 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -71.74 -34.69 69.73 Favored 'General case' 0 CA--C 1.491 -1.292 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.273 -176.842 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.547 ' O ' HD22 ' A' ' 100' ' ' LEU . . . -56.87 -62.26 6.56 Favored Glycine 0 N--CA 1.42 -2.389 0 N-CA-C 109.979 -1.248 . . . . 0.0 109.979 178.982 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.546 ' HB2' ' HB2' ' A' ' 31' ' ' TYR . 59.0 t-105 -50.75 -51.52 49.38 Favored 'General case' 0 N--CA 1.434 -1.227 0 C-N-CA 124.869 1.268 . . . . 0.0 110.215 176.184 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -49.15 -37.49 22.32 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 177.121 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 60.0 mttm -72.38 -51.67 19.43 Favored 'General case' 0 N--CA 1.416 -2.158 0 CA-C-O 119.434 -0.317 . . . . 0.0 110.386 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.547 HD22 ' O ' ' A' ' 96' ' ' GLY . 0.8 OUTLIER -56.94 -39.41 74.47 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.36 0.6 . . . . 0.0 111.504 179.09 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.484 ' O ' ' HA ' ' A' ' 105' ' ' THR . 53.7 t -72.26 -30.78 36.69 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.838 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.78 177.708 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 6.5 t -82.27 -24.96 34.47 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 121.07 -1.019 . . . . 0.0 108.889 -177.704 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' TRP . . . . . . . . . . . . . 47.2 m0 -83.64 -45.86 12.98 Favored 'General case' 0 N--CA 1.425 -1.683 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.598 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -131.42 7.64 4.56 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -175.671 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.484 ' HA ' ' O ' ' A' ' 101' ' ' VAL 0.304 35.2 p 57.77 168.37 0.04 OUTLIER 'General case' 0 N--CA 1.416 -2.139 0 N-CA-C 117.666 2.469 . . . . 0.0 117.666 -179.849 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -91.87 153.8 19.29 Favored 'General case' 0 C--N 1.291 -1.955 0 N-CA-C 105.781 -1.933 . . . . 0.0 105.781 -179.624 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 32.2 tpp -73.69 152.21 40.51 Favored 'General case' 0 N--CA 1.381 -3.913 0 CA-C-O 122.357 1.075 . . . . 0.0 110.887 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -63.6 135.31 56.7 Favored 'General case' 0 N--CA 1.395 -3.219 0 CA-C-N 112.979 -1.919 . . . . 0.0 110.006 179.258 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 80.25 5.77 89.55 Favored Glycine 0 N--CA 1.408 -3.203 0 CA-C-N 114.406 -1.27 . . . . 0.0 113.011 178.339 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -111.45 168.49 9.49 Favored 'General case' 0 CA--C 1.482 -1.64 0 CA-C-N 117.799 0.8 . . . . 0.0 110.975 177.392 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' GLU . . . . . 0.454 ' O ' HD12 ' A' ' 113' ' ' ILE . 7.5 mt-10 -142.87 144.4 29.31 Favored Pre-proline 0 C--N 1.276 -2.624 0 N-CA-C 106.511 -1.663 . . . . 0.0 106.511 -177.077 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_exo -58.58 122.76 12.19 Favored 'Trans proline' 0 CA--C 1.462 -3.101 0 C-N-CA 122.788 2.325 . . . . 0.0 112.773 -177.547 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.454 HD12 ' O ' ' A' ' 111' ' ' GLU . 3.2 mp -82.77 107.31 14.45 Favored 'Isoleucine or valine' 0 N--CA 1.383 -3.823 0 CA-C-N 113.248 -1.797 . . . . 0.0 107.052 175.586 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' ALA . . . . . 0.512 ' HB1' ' CG2' ' A' ' 29' ' ' THR . . . -92.46 124.95 36.87 Favored 'General case' 0 C--N 1.274 -2.7 0 CA-C-O 121.599 0.714 . . . . 0.0 109.44 177.454 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -127.78 124.06 36.75 Favored 'General case' 0 N--CA 1.401 -2.885 0 N-CA-C 105.403 -2.073 . . . . 0.0 105.403 -176.071 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -68.52 174.14 4.41 Favored 'General case' 0 C--N 1.29 -2.008 0 CA-C-O 121.651 0.738 . . . . 0.0 112.097 -177.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.694 HG11 ' O ' ' A' ' 25' ' ' ARG . 35.1 t . . . . . 0 C--N 1.306 -1.314 0 N-CA-C 105.633 -1.988 . . . . 0.0 105.633 169.853 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.473 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . . . . . . 0 CA--C 1.504 -0.8 0 CA-C-O 120.771 0.319 . . . . 0.0 111.031 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.609 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 16.5 t70 -72.84 146.67 46.08 Favored 'General case' 0 CA--C 1.481 -1.695 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 176.609 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -47.88 -48.74 31.23 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 124.65 1.18 . . . . 0.0 112.095 176.736 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -66.65 -37.58 85.11 Favored 'General case' 0 C--N 1.282 -2.341 0 CA-C-N 113.126 -1.852 . . . . 0.0 109.924 -178.799 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.473 ' CG2' ' HB1' ' A' ' 7' ' ' ALA . 3.4 m -65.37 -56.73 10.97 Favored 'General case' 0 N--CA 1.387 -3.576 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.548 177.957 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.609 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 76.5 mt-30 -44.55 -61.34 1.58 Allowed 'General case' 0 CA--C 1.508 -0.671 0 C-N-CA 125.035 1.334 . . . . 0.0 113.193 -173.664 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.488 ' HB3' HG21 ' A' ' 45' ' ' VAL . 0.0 OUTLIER -66.4 -35.34 80.07 Favored 'General case' 0 N--CA 1.432 -1.352 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 -174.6 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 33.1 t -77.75 -38.98 45.72 Favored 'General case' 0 C--N 1.28 -2.45 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.776 -178.835 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -65.62 -39.36 91.4 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 -177.084 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.604 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 34.8 mm -75.27 -39.64 42.54 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.383 0 CA-C-N 114.955 -1.02 . . . . 0.0 110.475 177.218 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.18 -33.66 72.52 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-O 121.531 0.681 . . . . 0.0 109.568 -178.598 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.57 ' HA ' ' HE2' ' A' ' 21' ' ' LYS . 1.0 OUTLIER -67.15 -31.33 71.68 Favored 'General case' 0 N--CA 1.407 -2.605 0 CA-C-N 114.25 -1.341 . . . . 0.0 112.153 178.791 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.486 ' HB3' ' HG2' ' A' ' 93' ' ' PRO . 71.3 mt -85.94 -16.97 36.7 Favored 'General case' 0 C--N 1.276 -2.59 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -177.705 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 11.0 mt -86.24 -24.42 26.03 Favored 'General case' 0 CA--C 1.502 -0.888 0 CA-C-O 121.231 0.539 . . . . 0.0 110.42 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.57 ' HE2' ' HA ' ' A' ' 18' ' ' THR . 39.6 pttt -86.74 -16.67 35.67 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.907 -171.57 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.4 m -55.33 137.56 47.45 Favored 'General case' 0 N--CA 1.402 -2.871 0 C-N-CA 125.662 1.585 . . . . 0.0 111.67 173.888 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.4 m -78.43 168.13 20.26 Favored 'General case' 0 N--CA 1.399 -2.994 0 CA-C-N 114.033 -1.44 . . . . 0.0 108.69 174.197 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.494 HD23 ' CZ2' ' A' ' 30' ' ' TRP 0.303 72.6 mt -74.69 138.47 42.84 Favored 'General case' 0 N--CA 1.397 -3.1 0 N-CA-C 116.321 1.971 . . . . 0.0 116.321 -173.812 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.497 ' HB2' ' HB2' ' A' ' 28' ' ' ASP . 7.4 mmm180 -81.54 -178.37 6.92 Favored 'General case' 0 C--N 1.29 -1.982 0 CA-C-N 111.288 -2.687 . . . . 0.0 107.746 -177.321 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 21.6 pttp -117.3 118.88 33.47 Favored 'General case' 0 C--N 1.292 -1.894 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 176.733 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 58.98 45.12 95.65 Favored Glycine 0 C--O 1.238 0.381 0 CA-C-O 121.479 0.488 . . . . 0.0 111.906 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.497 ' HB2' ' HB2' ' A' ' 25' ' ' ARG . 2.0 t0 -107.32 175.33 5.53 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 -177.81 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 31.2 m -119.19 123.41 44.29 Favored 'General case' 0 C--N 1.277 -2.581 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 179.694 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.494 ' CZ2' HD23 ' A' ' 24' ' ' LEU . 60.0 m95 -107.06 145.23 32.63 Favored 'General case' 0 C--N 1.279 -2.457 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 177.348 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.545 ' HB2' ' HB2' ' A' ' 97' ' ' TRP . 76.0 m-85 -109.01 127.58 54.21 Favored 'General case' 0 C--N 1.267 -3.01 0 CA-C-O 121.17 0.51 . . . . 0.0 110.933 -177.424 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.661 HD11 ' CD1' ' A' ' 89' ' ' TYR . 23.7 tp -88.33 134.06 33.91 Favored 'General case' 0 N--CA 1.379 -3.993 0 CA-C-N 114.095 -1.411 . . . . 0.0 114.514 -174.842 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 41.5 t -126.88 143.55 39.96 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.728 0 C-N-CA 126.64 1.976 . . . . 0.0 108.753 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.512 ' OD1' ' HB2' ' A' ' 36' ' ' ARG . 11.0 t70 -67.82 123.37 20.38 Favored 'General case' 0 C--N 1.307 -1.257 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 172.825 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 10.7 t -66.99 -24.26 66.02 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 120.664 0.269 . . . . 0.0 110.955 -172.551 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.512 ' HB2' ' OD1' ' A' ' 34' ' ' ASP . 13.9 mtm-85 -74.31 -25.23 59.45 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.241 0.544 . . . . 0.0 110.633 -177.159 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 69.5 t90 -72.74 -44.82 61.17 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 107.253 -1.388 . . . . 0.0 107.253 172.527 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.499 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 34.9 t80 -60.84 -37.84 83.42 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 114.773 -1.103 . . . . 0.0 110.798 178.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.441 ' HA ' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -52.65 -44.14 65.95 Favored 'General case' 0 C--N 1.352 0.714 0 N-CA-C 112.141 0.423 . . . . 0.0 112.141 174.026 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -64.54 -43.39 94.13 Favored 'General case' 0 N--CA 1.423 -1.782 0 C-N-CA 123.127 0.571 . . . . 0.0 109.756 179.093 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.629 ' O ' HG22 ' A' ' 45' ' ' VAL . 74.0 t90 -60.3 -40.29 90.0 Favored 'General case' 0 N--CA 1.429 -1.513 0 CA-C-N 114.642 -1.163 . . . . 0.0 111.009 179.229 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.499 ' HG3' ' O ' ' A' ' 38' ' ' PHE . 34.0 mtmt -52.08 -46.28 65.14 Favored 'General case' 0 CA--C 1.494 -1.193 0 O-C-N 123.357 0.411 . . . . 0.0 111.955 -179.678 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 61.6 mttm -69.33 -45.22 69.98 Favored 'General case' 0 CA--C 1.479 -1.75 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.572 -176.442 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.567 ' HB2' HG23 ' A' ' 60' ' ' VAL . 0.2 OUTLIER -57.96 -33.01 68.4 Favored 'General case' 0 N--CA 1.424 -1.748 0 CA-C-N 115.287 -0.869 . . . . 0.0 112.782 179.487 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.629 HG22 ' O ' ' A' ' 41' ' ' TRP . 3.7 m -95.16 -17.21 7.12 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.194 0 N-CA-C 113.692 0.997 . . . . 0.0 113.692 178.734 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 78.32 39.47 22.55 Favored Glycine 0 C--N 1.302 -1.325 0 N-CA-C 109.139 -1.584 . . . . 0.0 109.139 -172.652 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.459 ' HB2' HG23 ' A' ' 45' ' ' VAL . 46.6 t80 -74.25 -37.6 63.73 Favored 'General case' 0 N--CA 1.439 -1.012 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 178.27 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -74.23 120.92 20.46 Favored 'General case' 0 CA--C 1.49 -1.343 0 N-CA-C 106.677 -1.601 . . . . 0.0 106.677 174.313 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' SER . . . . . 0.534 ' HA ' ' HE3' ' A' ' 52' ' ' LYS . 30.5 m -58.65 -31.47 68.18 Favored 'General case' 0 C--N 1.298 -1.66 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -177.956 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 46.2 p90 -86.21 -15.0 42.26 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.354 -178.838 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 45.6 t0 -122.8 95.27 4.56 Favored 'General case' 0 CA--C 1.487 -1.476 0 CA-C-O 122.489 1.138 . . . . 0.0 110.871 -174.763 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.534 ' HE3' ' HA ' ' A' ' 49' ' ' SER . 34.3 mmtp -119.51 5.35 11.1 Favored 'General case' 0 C--N 1.284 -2.244 0 CA-C-N 113.624 -1.625 . . . . 0.0 108.621 -178.119 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 84.1 m-85 -78.54 -27.04 45.85 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.787 -174.775 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.566 ' HB3' HG11 ' A' ' 60' ' ' VAL . 9.5 mm100 -92.81 -3.11 55.27 Favored 'General case' 0 N--CA 1.404 -2.726 0 CA-C-N 114.746 -1.116 . . . . 0.0 110.683 -176.796 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' MET . . . . . 0.461 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 45.4 ttm -60.73 115.46 3.67 Favored 'General case' 0 N--CA 1.423 -1.808 0 C-N-CA 122.535 0.334 . . . . 0.0 110.535 -178.315 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.86 16.99 80.29 Favored Glycine 0 N--CA 1.439 -1.143 0 CA-C-N 115.437 -0.802 . . . . 0.0 112.251 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.584 ' HB3' HG22 ' A' ' 60' ' ' VAL . 5.9 t0 -91.74 147.5 22.94 Favored 'General case' 0 CA--C 1.502 -0.876 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 -178.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -83.5 -18.69 37.6 Favored 'General case' 0 C--N 1.295 -1.804 0 CA-C-O 121.909 0.861 . . . . 0.0 108.893 178.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 76.9 m-20 -62.34 -21.32 65.21 Favored 'General case' 0 CA--C 1.504 -0.815 0 CA-C-N 114.654 -1.157 . . . . 0.0 111.705 178.011 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.584 HG22 ' HB3' ' A' ' 57' ' ' ASP . 27.3 m -122.98 15.0 5.41 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.629 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.944 -176.631 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.443 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 1.1 p90 -55.89 120.14 31.14 Favored Pre-proline 0 C--N 1.292 -1.905 0 O-C-N 124.477 1.11 . . . . 0.0 111.439 -178.575 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.482 ' HG3' ' HA ' ' A' ' 41' ' ' TRP . 6.9 Cg_endo -91.4 115.03 0.41 Allowed 'Trans proline' 0 N--CA 1.421 -2.759 0 C-N-CA 122.909 2.406 . . . . 0.0 110.377 172.46 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -75.82 -153.85 4.58 Favored Glycine 0 C--N 1.282 -2.447 0 CA-C-N 114.256 -1.338 . . . . 0.0 111.964 175.042 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.412 ' HA ' ' O ' ' A' ' 104' ' ' TYR . 31.9 Cg_exo -57.35 144.08 92.23 Favored 'Trans proline' 0 C--O 1.244 0.786 0 C-N-CA 122.883 2.389 . . . . 0.0 111.88 -179.121 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 68.4 mt -64.69 118.55 7.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.22 -176.801 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.428 ' HB2' ' HG3' ' A' ' 107' ' ' MET . 12.6 t70 -106.85 109.46 21.37 Favored 'General case' 0 N--CA 1.436 -1.157 0 O-C-N 123.461 0.475 . . . . 0.0 110.086 179.226 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.44 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 94.9 m-20 -100.9 11.65 39.17 Favored 'General case' 0 C--N 1.297 -1.686 0 CA-C-N 115.384 -0.825 . . . . 0.0 111.644 179.403 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 75.7 m -69.9 -16.86 63.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.019 0.438 . . . . 0.0 111.089 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -72.75 -19.0 79.1 Favored Glycine 0 N--CA 1.44 -1.074 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 175.022 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.467 ' CD2' ' HB3' ' A' ' 89' ' ' TYR . 74.6 mt -96.06 -35.07 11.5 Favored 'General case' 0 CA--C 1.496 -1.134 0 CA-C-O 121.262 0.553 . . . . 0.0 109.623 177.483 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.604 HD13 ' HA ' ' A' ' 76' ' ' ALA . 87.8 mt -69.81 150.02 47.3 Favored 'General case' 0 N--CA 1.425 -1.691 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.198 -178.821 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 47.1 mtpt . . . . . 0 C--N 1.305 -1.344 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 -173.404 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.604 ' HA ' HD13 ' A' ' 71' ' ' LEU . . . . . . . . 0 N--CA 1.444 -0.736 0 CA-C-O 121.957 0.884 . . . . 0.0 110.207 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 16.9 mm-40 -123.42 4.07 9.07 Favored 'General case' 0 C--N 1.281 -2.38 0 N-CA-C 107.598 -1.26 . . . . 0.0 107.598 -178.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.485 ' O ' ' HA ' ' A' ' 71' ' ' LEU . 70.7 m -132.6 131.93 41.97 Favored 'General case' 0 C--N 1.286 -2.153 0 CA-C-N 114.296 -1.32 . . . . 0.0 112.368 -173.166 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 36.7 tp -94.97 143.92 26.09 Favored 'General case' 0 N--CA 1.389 -3.524 0 C-N-CA 125.438 1.495 . . . . 0.0 108.706 -178.511 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 56.1 mtmt -66.94 158.15 31.52 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 -178.044 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -69.81 -49.91 48.09 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 114.336 1.236 . . . . 0.0 114.336 -167.567 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 29.9 m170 -93.48 12.01 26.57 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.439 0.903 . . . . 0.0 113.439 -170.541 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 16.3 mt -72.69 130.38 40.39 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-O 121.701 0.762 . . . . 0.0 112.555 -174.823 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.658 HG21 HD12 ' A' ' 87' ' ' LEU . 50.7 mm -101.19 175.13 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.935 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 -179.566 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.566 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 6.3 p-10 -64.59 -141.15 0.0 OUTLIER 'General case' 0 C--O 1.2 -1.538 0 C-N-CA 124.915 1.286 . . . . 0.0 112.158 -177.601 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.547 ' HA ' ' O ' ' A' ' 89' ' ' TYR . 0.0 OUTLIER -40.88 -19.9 0.01 OUTLIER 'General case' 0 N--CA 1.516 2.868 0 N-CA-C 115.804 1.779 . . . . 0.0 115.804 -173.865 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.658 HD12 HG21 ' A' ' 84' ' ' ILE . 15.2 mt -58.4 -53.52 57.41 Favored 'General case' 0 C--N 1.29 -2.017 0 C-N-CA 124.056 0.943 . . . . 0.0 109.88 171.618 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -107.11 -40.57 5.39 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.266 0.555 . . . . 0.0 111.138 -178.449 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' TYR . . . . . 0.661 ' CD1' HD11 ' A' ' 32' ' ' LEU . 1.8 p90 -140.31 174.13 10.82 Favored 'General case' 0 C--O 1.159 -3.671 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.832 -175.091 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.506 ' O ' HD12 ' A' ' 32' ' ' LEU . 6.0 mt -138.81 143.83 31.13 Favored 'Isoleucine or valine' 0 CA--C 1.481 -1.709 0 O-C-N 120.899 -1.126 . . . . 0.0 110.811 178.054 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.48 ' HA ' HD23 ' A' ' 91' ' ' LEU . 57.5 mt -106.24 128.11 53.72 Favored 'General case' 0 N--CA 1.404 -2.738 0 CA-C-N 114.183 -1.371 . . . . 0.0 111.838 177.938 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -115.92 149.75 43.8 Favored Pre-proline 0 C--N 1.272 -2.799 0 CA-C-N 113.064 -1.88 . . . . 0.0 106.236 -178.048 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.486 ' HG2' ' HB3' ' A' ' 19' ' ' LEU . 38.8 Cg_exo -65.36 169.13 12.97 Favored 'Trans proline' 0 N--CA 1.439 -1.679 0 N-CA-C 107.782 -1.661 . . . . 0.0 107.782 168.071 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 10.4 m -40.38 -47.96 2.64 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 123.928 0.767 . . . . 0.0 110.633 172.531 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -68.06 -39.8 82.93 Favored 'General case' 0 C--O 1.208 -1.129 0 CA-C-N 114.637 -1.165 . . . . 0.0 112.047 -175.054 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.475 ' O ' ' HG ' ' A' ' 100' ' ' LEU . . . -61.19 -52.89 48.96 Favored Glycine 0 N--CA 1.433 -1.518 0 N-CA-C 110.619 -0.992 . . . . 0.0 110.619 -178.984 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.545 ' HB2' ' HB2' ' A' ' 31' ' ' TYR . 69.5 t-105 -55.66 -53.33 57.81 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 123.596 0.758 . . . . 0.0 110.273 174.872 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 97.0 m-20 -46.86 -41.47 15.77 Favored 'General case' 0 C--O 1.199 -1.591 0 C-N-CA 123.349 0.66 . . . . 0.0 111.688 176.831 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.436 ' HB2' ' O ' ' A' ' 96' ' ' GLY . 41.6 mttm -64.46 -53.88 41.34 Favored 'General case' 0 CA--C 1.477 -1.862 0 CA-C-O 121.553 0.692 . . . . 0.0 109.989 -178.736 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 96' ' ' GLY . 77.8 mt -65.53 -33.42 75.88 Favored 'General case' 0 C--N 1.265 -3.096 0 CA-C-N 114.502 -1.226 . . . . 0.0 112.694 -176.148 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.428 ' O ' ' HA ' ' A' ' 105' ' ' THR . 48.1 t -79.64 -25.81 12.37 Favored 'Isoleucine or valine' 0 N--CA 1.4 -2.956 0 CA-C-O 121.494 0.664 . . . . 0.0 110.864 176.04 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 62.4 m -76.2 -38.04 57.01 Favored 'General case' 0 N--CA 1.419 -1.998 0 O-C-N 121.189 -0.944 . . . . 0.0 109.621 175.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' TRP . . . . . 0.406 ' CE3' HD23 ' A' ' 100' ' ' LEU . 28.8 m0 -82.17 -44.13 16.82 Favored 'General case' 0 N--CA 1.435 -1.215 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.424 -177.295 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' TYR . . . . . 0.412 ' O ' ' HA ' ' A' ' 64' ' ' PRO . 36.7 m-85 -119.95 -12.12 9.2 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -172.431 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.428 ' HA ' ' O ' ' A' ' 101' ' ' VAL 0.333 11.7 t 53.63 -174.44 0.03 OUTLIER 'General case' 0 C--O 1.24 0.604 0 C-N-CA 126.501 1.92 . . . . 0.0 114.009 -172.9 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -105.32 148.33 27.16 Favored 'General case' 0 C--N 1.248 -3.848 0 CA-C-N 113.425 -1.716 . . . . 0.0 109.212 -171.694 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' MET . . . . . 0.428 ' HG3' ' HB2' ' A' ' 66' ' ' ASP . 68.4 mmm -73.13 156.92 38.16 Favored 'General case' 0 CA--C 1.504 -0.822 0 CA-C-O 120.926 0.393 . . . . 0.0 111.503 175.619 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -61.17 148.37 40.99 Favored 'General case' 0 C--N 1.31 -1.12 0 C-N-CA 124.55 1.14 . . . . 0.0 112.011 -179.765 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 78.49 -23.89 2.77 Favored Glycine 0 N--CA 1.432 -1.588 0 CA-C-N 114.535 -1.212 . . . . 0.0 113.551 175.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -85.37 159.39 20.01 Favored 'General case' 0 N--CA 1.426 -1.661 0 CA-C-O 121.672 0.748 . . . . 0.0 111.175 -176.421 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -134.98 156.03 78.73 Favored Pre-proline 0 C--N 1.273 -2.743 0 N-CA-C 106.303 -1.74 . . . . 0.0 106.303 175.673 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -58.36 122.44 11.68 Favored 'Trans proline' 0 CA--C 1.469 -2.726 0 C-N-CA 122.431 2.088 . . . . 0.0 111.159 176.071 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.53 ' HB ' ' HB3' ' A' ' 32' ' ' LEU . 63.0 mt -84.42 106.63 14.8 Favored 'Isoleucine or valine' 0 N--CA 1.381 -3.879 0 CA-C-N 113.028 -1.896 . . . . 0.0 106.933 179.085 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -94.74 125.76 39.61 Favored 'General case' 0 C--N 1.27 -2.883 0 CA-C-O 121.725 0.774 . . . . 0.0 110.377 -179.451 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 10.1 tpt180 -125.72 115.05 19.47 Favored 'General case' 0 N--CA 1.4 -2.952 0 N-CA-C 105.31 -2.107 . . . . 0.0 105.31 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -73.53 166.19 23.69 Favored 'General case' 0 C--N 1.274 -2.683 0 C-N-CA 120.37 -0.532 . . . . 0.0 111.103 -179.457 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 87.3 t . . . . . 0 C--O 1.242 0.677 0 O-C-N 124.0 0.813 . . . . 0.0 109.595 178.758 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.491 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . . . . . . 0 N--CA 1.435 -1.216 0 CA-C-O 120.652 0.263 . . . . 0.0 110.806 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.693 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 25.0 t70 -70.58 146.27 50.21 Favored 'General case' 0 CA--C 1.465 -2.299 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 174.545 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.496 ' O ' ' HG2' ' A' ' 13' ' ' ARG . 28.5 mt -53.79 -43.88 69.67 Favored 'General case' 0 CA--C 1.487 -1.454 0 CA-C-N 119.085 0.857 . . . . 0.0 111.166 -177.756 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -68.24 -24.19 64.88 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 114.897 -1.047 . . . . 0.0 110.094 -176.281 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.583 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 5.1 m -78.79 -50.77 10.75 Favored 'General case' 0 N--CA 1.38 -3.931 0 CA-C-N 114.498 -1.228 . . . . 0.0 109.462 175.092 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.693 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 52.0 mt-30 -49.16 -61.12 2.25 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.966 0.906 . . . . 0.0 112.298 -175.42 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.496 ' HG2' ' O ' ' A' ' 9' ' ' LEU . 1.6 ptm180 -49.05 -43.43 40.79 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-O 121.701 0.763 . . . . 0.0 112.356 177.619 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.4 m -75.32 -34.6 61.25 Favored 'General case' 0 C--N 1.278 -2.534 0 CA-C-N 114.549 -1.205 . . . . 0.0 112.493 -176.845 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.5 t0 -77.08 -36.74 55.55 Favored 'General case' 0 C--N 1.3 -1.582 0 C-N-CA 123.786 0.834 . . . . 0.0 109.628 -177.01 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.61 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 27.3 mm -73.12 -33.05 41.13 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.244 0 C-N-CA 123.235 0.614 . . . . 0.0 110.468 177.056 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.34 -36.46 71.19 Favored 'General case' 0 CA--C 1.502 -0.89 0 O-C-N 123.855 0.722 . . . . 0.0 109.092 -178.019 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.549 ' O ' ' HG3' ' A' ' 21' ' ' LYS . 24.7 m -54.15 -57.12 12.32 Favored 'General case' 0 N--CA 1.405 -2.708 0 C-N-CA 125.757 1.623 . . . . 0.0 111.096 177.663 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.518 ' HB3' ' HD2' ' A' ' 93' ' ' PRO . 2.7 mm? -66.81 -18.05 65.19 Favored 'General case' 1 N--CA 1.377 -4.099 0 N-CA-C 114.63 1.345 . . . . 0.0 114.63 -178.213 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.61 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 10.0 mt -84.43 -26.08 28.53 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-O 121.64 0.733 . . . . 0.0 109.442 178.593 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.549 ' HG3' ' O ' ' A' ' 18' ' ' THR . 0.0 OUTLIER -91.86 -7.57 48.95 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-N 114.667 -1.152 . . . . 0.0 110.822 -173.628 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 51.9 m -71.25 139.07 49.91 Favored 'General case' 0 N--CA 1.394 -3.275 0 CA-C-N 113.354 -1.748 . . . . 0.0 111.138 177.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 73.7 m -87.3 132.22 34.0 Favored 'General case' 0 N--CA 1.389 -3.501 0 CA-C-N 113.777 -1.556 . . . . 0.0 109.61 176.69 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.659 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP . 0.6 OUTLIER -80.21 160.09 25.73 Favored 'General case' 0 C--N 1.296 -1.756 0 N-CA-C 114.21 1.189 . . . . 0.0 114.21 -176.969 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.433 ' O ' HG21 ' A' ' 117' ' ' VAL . 0.0 OUTLIER -101.74 144.08 30.88 Favored 'General case' 0 C--N 1.295 -1.802 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 177.348 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -54.51 -22.2 12.24 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 116.649 2.092 . . . . 0.0 116.649 -169.178 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -134.7 33.53 2.47 Favored Glycine 0 C--N 1.293 -1.808 0 N-CA-C 110.409 -1.076 . . . . 0.0 110.409 -179.599 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.421 ' HB2' ' HB2' ' A' ' 25' ' ' ARG . 2.5 t70 -85.54 -177.17 6.36 Favored 'General case' 0 C--N 1.315 -0.933 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.285 -178.212 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.515 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 85.6 m -129.04 121.67 28.39 Favored 'General case' 0 N--CA 1.438 -1.061 0 CA-C-O 121.375 0.607 . . . . 0.0 110.249 -177.768 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.659 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 15.2 m95 -113.31 148.97 34.62 Favored 'General case' 0 N--CA 1.424 -1.767 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.35 -179.043 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.405 ' HB2' ' HB2' ' A' ' 97' ' ' TRP . 86.7 m-85 -106.68 142.68 35.94 Favored 'General case' 0 C--N 1.292 -1.922 0 C-N-CA 123.07 0.548 . . . . 0.0 111.385 -175.689 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.633 HD13 HG22 ' A' ' 113' ' ' ILE . 6.2 mp -93.17 133.18 36.62 Favored 'General case' 0 CA--C 1.496 -1.096 0 CA-C-O 122.184 0.992 . . . . 0.0 113.606 -177.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.439 HG12 ' O ' ' A' ' 34' ' ' ASP . 53.4 t -117.06 142.45 30.89 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.484 0 N-CA-C 104.845 -2.28 . . . . 0.0 104.845 174.046 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.439 ' O ' HG12 ' A' ' 33' ' ' VAL . 4.5 t0 -67.28 127.7 33.65 Favored 'General case' 0 C--N 1.288 -2.078 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 172.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 6.5 t -66.46 -30.16 70.44 Favored 'General case' 0 N--CA 1.423 -1.789 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 -174.694 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 47.1 mtp85 -71.52 -29.78 65.17 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.149 -176.927 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.445 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 70.6 t90 -69.6 -46.96 65.09 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 173.824 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.492 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 28.9 t80 -61.53 -41.88 97.99 Favored 'General case' 0 C--O 1.212 -0.886 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.075 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.495 ' HA ' ' HE3' ' A' ' 42' ' ' LYS . 0.1 OUTLIER -55.5 -41.2 72.75 Favored 'General case' 0 N--CA 1.439 -1.004 0 O-C-N 122.007 -0.433 . . . . 0.0 111.855 175.091 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.445 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 21.5 tp60 -65.45 -42.38 92.4 Favored 'General case' 0 N--CA 1.423 -1.81 0 C-N-CA 123.495 0.718 . . . . 0.0 109.698 176.45 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 65.2 t90 -61.1 -39.98 92.01 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.592 177.442 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.495 ' HE3' ' HA ' ' A' ' 39' ' ' LYS . 8.3 mtmp? -56.99 -42.81 80.93 Favored 'General case' 0 CA--C 1.495 -1.17 0 CA-C-N 117.948 0.34 . . . . 0.0 110.991 -179.691 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.514 ' HB3' ' HB2' ' A' ' 54' ' ' GLN . 93.5 mttt -58.63 -52.14 66.95 Favored 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 124.175 0.922 . . . . 0.0 109.283 178.37 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.528 ' HB2' HG23 ' A' ' 60' ' ' VAL . 0.4 OUTLIER -65.55 -41.13 93.34 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-N 114.175 -1.375 . . . . 0.0 112.482 -172.48 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.423 ' CG1' ' HB2' ' A' ' 47' ' ' PHE . 3.7 p -90.47 -12.72 9.44 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.721 0 CA-C-N 116.313 -0.403 . . . . 0.0 112.026 -175.678 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.776 ' HA2' ' HB2' ' A' ' 52' ' ' LYS . . . 64.23 45.32 93.89 Favored Glycine 0 N--CA 1.4 -3.72 0 C-N-CA 121.183 -0.532 . . . . 0.0 112.689 -171.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.423 ' HB2' ' CG1' ' A' ' 45' ' ' VAL . 94.5 t80 -66.44 -52.94 41.11 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 123.607 0.763 . . . . 0.0 112.002 -178.254 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.468 ' OD1' ' HB3' ' A' ' 42' ' ' LYS . 16.5 p-10 -99.08 99.64 10.68 Favored 'General case' 0 C--N 1.289 -2.051 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.923 -176.074 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 8.9 m -49.8 -29.73 8.41 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 125.547 1.539 . . . . 0.0 114.158 -176.006 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.432 ' CE2' ' HB2' ' A' ' 48' ' ' ASP . 49.1 p90 -72.56 -11.66 60.74 Favored 'General case' 0 C--N 1.322 -0.589 0 O-C-N 122.044 -0.41 . . . . 0.0 111.428 179.377 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.437 ' O ' ' HD2' ' A' ' 52' ' ' LYS . 20.1 t70 -129.26 -94.34 0.42 Allowed 'General case' 0 C--N 1.304 -1.387 0 CA-C-O 118.508 -0.758 . . . . 0.0 109.769 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.776 ' HB2' ' HA2' ' A' ' 46' ' ' GLY . 0.0 OUTLIER 42.8 29.11 0.15 Allowed 'General case' 0 CA--C 1.554 1.12 0 N-CA-C 116.392 1.997 . . . . 0.0 116.392 172.087 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.422 ' HD1' ' H ' ' A' ' 53' ' ' TYR . 1.6 p90 -63.82 -5.08 3.77 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 115.407 1.632 . . . . 0.0 115.407 -173.343 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.514 ' HB2' ' HB3' ' A' ' 43' ' ' LYS . 10.5 mm-40 -128.1 23.86 6.03 Favored 'General case' 0 C--N 1.285 -2.213 0 C-N-CA 124.015 0.926 . . . . 0.0 110.651 -171.321 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 50.4 ttm -57.0 108.26 0.49 Allowed 'General case' 0 N--CA 1.437 -1.098 0 C-N-CA 124.052 0.941 . . . . 0.0 110.784 -179.278 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.27 16.84 73.14 Favored Glycine 0 N--CA 1.434 -1.464 0 CA-C-N 115.855 -0.611 . . . . 0.0 112.299 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.552 ' HB3' HG22 ' A' ' 60' ' ' VAL . 7.6 t0 -86.97 148.56 25.27 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 178.405 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.464 ' O ' ' HD1' ' A' ' 61' ' ' TYR . 28.6 pt20 -85.19 -23.26 28.41 Favored 'General case' 0 C--N 1.292 -1.931 0 CA-C-O 121.493 0.663 . . . . 0.0 111.287 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 -62.04 -18.16 59.73 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-O 121.93 0.871 . . . . 0.0 111.699 -179.309 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.552 HG22 ' HB3' ' A' ' 57' ' ' ASP . 29.3 m -116.64 8.22 7.22 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.098 0 CA-C-N 115.028 -0.987 . . . . 0.0 112.225 -173.154 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.464 ' HD1' ' O ' ' A' ' 58' ' ' GLN . 2.8 p90 -60.37 116.85 19.62 Favored Pre-proline 0 C--N 1.308 -1.215 0 O-C-N 124.215 0.947 . . . . 0.0 110.681 -179.484 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 61' ' ' TYR . 7.7 Cg_endo -89.94 110.48 0.43 Allowed 'Trans proline' 0 N--CA 1.42 -2.818 0 C-N-CA 122.695 2.264 . . . . 0.0 109.39 175.411 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -69.66 -146.79 0.26 Allowed Glycine 0 C--N 1.291 -1.935 0 CA-C-N 115.03 -0.986 . . . . 0.0 112.879 177.307 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.637 ' HA ' ' O ' ' A' ' 104' ' ' TYR . 32.8 Cg_exo -55.34 134.47 64.06 Favored 'Trans proline' 0 C--O 1.247 0.94 0 C-N-CA 122.778 2.319 . . . . 0.0 112.2 -177.167 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.447 HD11 ' HB3' ' A' ' 100' ' ' LEU . 78.9 mt -62.29 125.14 18.12 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.039 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.433 -178.216 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.474 ' HB3' ' SD ' ' A' ' 107' ' ' MET . 7.1 p-10 -108.38 122.37 46.86 Favored 'General case' 0 N--CA 1.407 -2.602 0 CA-C-O 122.247 1.022 . . . . 0.0 109.222 177.797 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.567 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 93.8 m-20 -100.52 9.65 42.26 Favored 'General case' 0 C--N 1.279 -2.47 0 N-CA-C 107.189 -1.412 . . . . 0.0 107.189 171.182 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 6.0 m -57.28 -34.25 68.47 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 124.965 1.306 . . . . 0.0 111.12 -178.73 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -77.91 -13.01 83.86 Favored Glycine 0 N--CA 1.438 -1.171 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.272 178.53 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 36.6 mt -100.03 -14.77 18.49 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 179.446 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.567 ' HG ' ' O ' ' A' ' 67' ' ' ASN . 99.6 mt -80.43 139.19 36.58 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.863 -178.426 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt . . . . . 0 C--N 1.309 -1.168 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.581 175.235 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.464 ' HA ' HD13 ' A' ' 71' ' ' LEU . . . . . . . . 0 N--CA 1.437 -1.083 0 CA-C-O 121.898 0.856 . . . . 0.0 109.254 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 56.8 mm-40 -118.66 -2.63 10.93 Favored 'General case' 0 C--N 1.299 -1.61 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 24.2 p -90.87 116.89 29.04 Favored 'General case' 0 N--CA 1.424 -1.764 0 CA-C-N 113.854 -1.521 . . . . 0.0 109.729 -177.594 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 19.1 tp -98.29 138.86 34.93 Favored 'General case' 0 N--CA 1.39 -3.444 0 C-N-CA 124.371 1.068 . . . . 0.0 110.068 -176.281 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.465 ' CB ' HD13 ' A' ' 83' ' ' LEU . 68.3 mttm -61.31 139.09 58.23 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.556 0.693 . . . . 0.0 111.26 177.593 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -89.28 -19.51 25.25 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-N 114.722 -1.126 . . . . 0.0 113.918 -168.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 28.5 m170 -86.28 -10.98 53.47 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -175.66 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.465 HD13 ' CB ' ' A' ' 80' ' ' LYS . 8.2 mp -76.77 139.2 40.32 Favored 'General case' 0 C--N 1.295 -1.768 0 N-CA-C 114.948 1.462 . . . . 0.0 114.948 -172.297 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.615 HG21 HD12 ' A' ' 87' ' ' LEU . 58.0 mt -101.05 178.06 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.426 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 176.339 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.719 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 12.2 t70 -64.87 -130.72 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.557 0 C-N-CA 124.372 1.069 . . . . 0.0 110.186 -177.295 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.42 ' HA ' ' O ' ' A' ' 89' ' ' TYR . 6.8 tp10 -38.43 -24.08 0.01 OUTLIER 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 127.585 2.354 . . . . 0.0 114.792 -179.192 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.615 HD12 HG21 ' A' ' 84' ' ' ILE . 18.6 mt -66.43 -47.5 73.03 Favored 'General case' 0 C--N 1.284 -2.28 0 C-N-CA 123.33 0.652 . . . . 0.0 110.821 177.159 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -113.63 -34.28 5.58 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.41 -175.794 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' TYR . . . . . 0.719 ' CE1' ' HA ' ' A' ' 85' ' ' ASP . 3.7 p90 -142.41 -163.87 1.7 Allowed 'General case' 0 C--O 1.187 -2.227 0 N-CA-C 106.315 -1.735 . . . . 0.0 106.315 -179.433 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.564 ' O ' ' HA ' ' A' ' 32' ' ' LEU . 4.7 mt -147.68 148.2 16.6 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.235 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 171.918 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.541 HD21 ' CD1' ' A' ' 32' ' ' LEU . 26.6 mt -109.81 126.2 53.54 Favored 'General case' 0 N--CA 1.397 -3.113 0 O-C-N 124.532 1.145 . . . . 0.0 111.476 175.329 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.411 HD23 HG23 ' A' ' 33' ' ' VAL . 1.6 mm? -118.86 149.51 46.74 Favored Pre-proline 0 C--N 1.306 -1.317 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.686 -177.86 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.518 ' HD2' ' HB3' ' A' ' 19' ' ' LEU . 50.0 Cg_exo -61.71 168.67 8.14 Favored 'Trans proline' 0 C--O 1.257 1.465 0 C-N-CA 122.051 1.834 . . . . 0.0 108.51 164.626 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 19.5 m -46.79 -41.01 14.74 Favored 'General case' 0 C--N 1.306 -1.321 0 O-C-N 123.607 0.567 . . . . 0.0 111.05 174.58 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 5.8 mp0 -61.96 -52.7 62.95 Favored 'General case' 0 CA--C 1.5 -0.95 0 C-N-CA 124.538 1.135 . . . . 0.0 111.046 -178.544 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.478 ' O ' ' HG ' ' A' ' 100' ' ' LEU . . . -56.07 -54.28 36.6 Favored Glycine 0 N--CA 1.429 -1.795 0 O-C-N 124.015 0.822 . . . . 0.0 111.848 -176.456 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.405 ' HB2' ' HB2' ' A' ' 31' ' ' TYR . 70.9 t-105 -55.65 -51.09 68.38 Favored 'General case' 0 N--CA 1.425 -1.724 0 C-N-CA 123.007 0.523 . . . . 0.0 111.312 176.148 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 -52.37 -34.97 50.21 Favored 'General case' 0 CA--C 1.485 -1.533 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 177.071 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.447 ' HB2' ' O ' ' A' ' 96' ' ' GLY . 54.2 mttm -67.01 -52.11 46.51 Favored 'General case' 0 CA--C 1.468 -2.21 0 CA-C-O 121.375 0.607 . . . . 0.0 110.419 178.983 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 96' ' ' GLY . 69.1 mt -65.99 -35.92 81.89 Favored 'General case' 0 C--N 1.261 -3.25 0 CA-C-N 114.752 -1.113 . . . . 0.0 111.945 -175.683 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.497 ' HA ' ' HA ' ' A' ' 105' ' ' THR . 18.6 t -77.59 -25.41 14.8 Favored 'Isoleucine or valine' 0 N--CA 1.399 -2.995 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.723 174.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 38.2 t -74.46 -38.22 63.02 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 176.637 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' TRP . . . . . 0.497 ' CZ3' ' HB3' ' A' ' 12' ' ' GLN . 36.7 m0 -77.85 -54.56 6.18 Favored 'General case' 0 N--CA 1.422 -1.834 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.201 -176.022 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' TYR . . . . . 0.637 ' O ' ' HA ' ' A' ' 64' ' ' PRO . 30.9 m-85 -127.88 13.21 6.82 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 114.255 1.206 . . . . 0.0 114.255 -175.505 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' A' ' 101' ' ' VAL 0.252 10.0 t 47.28 -170.05 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 126.256 1.822 . . . . 0.0 115.473 178.755 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 52.6 tp -115.39 142.15 47.08 Favored 'General case' 0 C--N 1.26 -3.309 0 CA-C-N 113.29 -1.777 . . . . 0.0 109.006 -175.819 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' MET . . . . . 0.474 ' SD ' ' HB3' ' A' ' 66' ' ' ASP . 72.9 mtp -63.18 156.37 25.44 Favored 'General case' 0 CA--C 1.508 -0.656 0 CA-C-O 122.155 0.979 . . . . 0.0 113.621 178.6 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -71.53 147.66 47.5 Favored 'General case' 0 N--CA 1.413 -2.32 0 CA-C-N 113.967 -1.469 . . . . 0.0 111.533 178.563 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 94.76 -24.48 27.93 Favored Glycine 0 N--CA 1.418 -2.545 0 CA-C-N 114.926 -1.034 . . . . 0.0 113.504 175.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -113.65 169.86 8.67 Favored 'General case' 0 N--CA 1.421 -1.914 0 CA-C-O 120.698 0.285 . . . . 0.0 110.501 -177.217 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 65.8 mm-40 -137.1 155.57 76.01 Favored Pre-proline 0 C--N 1.301 -1.503 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 -177.598 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_exo -56.62 124.57 16.57 Favored 'Trans proline' 0 CA--C 1.463 -3.047 0 C-N-CA 123.498 2.798 . . . . 0.0 113.012 -177.909 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.633 HG22 HD13 ' A' ' 32' ' ' LEU . 2.6 mp -83.36 110.21 17.96 Favored 'Isoleucine or valine' 0 N--CA 1.384 -3.755 0 N-CA-C 106.534 -1.654 . . . . 0.0 106.534 175.292 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' ALA . . . . . 0.515 ' HB1' ' CG2' ' A' ' 29' ' ' THR . . . -107.13 132.85 52.56 Favored 'General case' 0 C--N 1.281 -2.387 0 CA-C-N 115.426 -0.806 . . . . 0.0 108.901 178.515 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.549 ' HB2' HD11 ' A' ' 32' ' ' LEU . 5.4 tpt180 -130.33 135.24 47.85 Favored 'General case' 0 N--CA 1.407 -2.616 0 N-CA-C 105.706 -1.961 . . . . 0.0 105.706 -178.505 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -84.23 168.58 15.6 Favored 'General case' 0 C--N 1.272 -2.792 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -175.74 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.433 HG21 ' O ' ' A' ' 25' ' ' ARG . 90.4 t . . . . . 0 N--CA 1.42 -1.967 0 CA-C-O 122.376 1.084 . . . . 0.0 111.177 -177.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.541 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . . . . . . 0 C--O 1.248 1.026 0 CA-C-O 120.92 0.391 . . . . 0.0 111.213 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.607 ' O ' ' HB ' ' A' ' 11' ' ' THR . 19.6 t70 -78.37 157.55 29.04 Favored 'General case' 0 C--O 1.178 -2.7 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 176.327 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.471 ' O ' ' HG3' ' A' ' 13' ' ' ARG . 32.5 mt -59.1 -33.89 71.36 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 118.945 0.793 . . . . 0.0 111.608 -177.065 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.409 ' HA ' ' NH1' ' A' ' 13' ' ' ARG . 18.4 t70 -73.13 -30.0 63.3 Favored 'General case' 0 C--N 1.281 -2.396 0 CA-C-N 114.003 -1.453 . . . . 0.0 108.965 -178.896 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.607 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 56.2 m -78.12 -49.74 13.33 Favored 'General case' 0 N--CA 1.382 -3.837 0 CA-C-N 113.887 -1.506 . . . . 0.0 110.233 177.332 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.521 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 25.7 mt-30 -55.42 -57.29 12.47 Favored 'General case' 0 C--N 1.346 0.443 0 C-N-CA 123.171 0.588 . . . . 0.0 112.132 -172.243 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.607 ' HG2' HG13 ' A' ' 45' ' ' VAL . 42.4 mtm-85 -44.64 -54.28 6.32 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-O 121.698 0.761 . . . . 0.0 109.896 177.657 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 59.7 m -65.63 -48.92 70.59 Favored 'General case' 0 N--CA 1.419 -2.004 0 CA-C-N 113.467 -1.697 . . . . 0.0 112.732 -172.187 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -66.54 -35.27 79.82 Favored 'General case' 0 C--N 1.314 -0.977 0 C-N-CA 124.169 0.988 . . . . 0.0 109.841 -175.281 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 30.4 mm -77.67 -44.53 29.17 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.303 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.769 176.783 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.15 -35.87 67.65 Favored 'General case' 0 CA--C 1.493 -1.239 0 CA-C-O 121.349 0.595 . . . . 0.0 109.558 -176.468 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 3.0 m -54.87 -42.77 72.47 Favored 'General case' 0 N--CA 1.394 -3.266 0 C-N-CA 126.017 1.727 . . . . 0.0 112.069 177.799 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.568 HD11 ' HE3' ' A' ' 99' ' ' LYS . 64.4 mt -83.7 -23.48 31.67 Favored 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -171.321 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.92 -26.46 68.32 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 122.046 0.927 . . . . 0.0 109.999 170.539 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -91.22 -36.15 14.1 Favored 'General case' 0 C--N 1.29 -1.984 0 CA-C-N 114.081 -1.418 . . . . 0.0 110.633 -173.683 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 93.5 m -47.35 139.32 6.57 Favored 'General case' 0 N--CA 1.409 -2.515 0 C-N-CA 125.086 1.354 . . . . 0.0 111.697 173.697 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.2 t -90.57 166.27 13.3 Favored 'General case' 0 N--CA 1.41 -2.444 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.001 -172.132 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.532 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP . 0.5 OUTLIER -119.23 166.43 12.99 Favored 'General case' 0 N--CA 1.413 -2.297 0 CA-C-N 115.018 -0.992 . . . . 0.0 113.443 -179.105 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.478 ' O ' HG21 ' A' ' 117' ' ' VAL . 32.7 mmm180 -139.07 138.72 37.36 Favored 'General case' 0 CA--C 1.489 -1.399 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 179.354 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -62.22 109.65 1.38 Allowed 'General case' 0 C--N 1.301 -1.513 0 CA-C-O 121.994 0.902 . . . . 0.0 113.227 -177.016 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 128.44 -16.86 5.92 Favored Glycine 0 N--CA 1.423 -2.177 0 CA-C-N 113.854 -1.521 . . . . 0.0 110.01 -174.466 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 39.2 t0 -73.16 155.58 39.48 Favored 'General case' 0 CA--C 1.502 -0.897 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 18.6 m -115.83 123.88 49.28 Favored 'General case' 0 C--N 1.28 -2.456 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 -177.314 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.532 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 15.9 m95 -112.97 162.36 15.95 Favored 'General case' 0 C--N 1.285 -2.198 0 N-CA-C 107.707 -1.22 . . . . 0.0 107.707 178.708 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.463 ' CD1' ' HA ' ' A' ' 94' ' ' THR . 52.2 m-85 -117.56 141.93 47.78 Favored 'General case' 0 C--N 1.274 -2.694 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.679 ' HA ' ' O ' ' A' ' 90' ' ' ILE 0.414 0.4 OUTLIER -106.36 132.05 52.85 Favored 'General case' 0 N--CA 1.424 -1.741 0 N-CA-C 114.385 1.254 . . . . 0.0 114.385 179.525 . . . . . . . . 4 4 . 1 . 010 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.438 HG12 ' O ' ' A' ' 34' ' ' ASP . 89.9 t -110.49 151.21 12.74 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.485 0 CA-C-N 112.403 -2.18 . . . . 0.0 106.4 -176.934 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.499 ' OD1' ' HG2' ' A' ' 36' ' ' ARG . 18.7 t0 -72.91 131.69 42.53 Favored 'General case' 0 C--N 1.296 -1.723 0 N-CA-C 106.895 -1.521 . . . . 0.0 106.895 171.411 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.4 t -71.94 -22.7 61.43 Favored 'General case' 0 N--CA 1.422 -1.864 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 -171.263 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.564 HH11 ' HG2' ' A' ' 36' ' ' ARG . 9.3 mmt-85 -70.49 -36.91 74.08 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.413 -177.346 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.416 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 71.5 t90 -70.94 -43.19 68.67 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 178.914 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.521 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 41.3 t80 -61.29 -41.83 97.63 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.096 179.024 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.48 ' HA ' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -53.03 -45.58 68.06 Favored 'General case' 0 N--CA 1.425 -1.682 0 C-N-CA 122.426 0.29 . . . . 0.0 111.183 174.106 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.416 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 5.9 tp-100 -64.09 -39.49 94.17 Favored 'General case' 0 N--CA 1.426 -1.661 0 C-N-CA 124.059 0.944 . . . . 0.0 110.74 179.039 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 65.6 t90 -61.35 -38.08 85.67 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.847 176.738 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.521 ' HG3' ' O ' ' A' ' 38' ' ' PHE . 33.1 mtmt -59.15 -41.06 87.45 Favored 'General case' 0 CA--C 1.5 -0.971 0 CA-C-O 120.712 0.291 . . . . 0.0 111.268 -179.049 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.537 ' HG2' ' OD2' ' A' ' 51' ' ' ASP . 18.5 mtpp -66.94 -36.58 82.55 Favored 'General case' 0 C--N 1.311 -1.109 0 CA-C-N 115.101 -0.954 . . . . 0.0 108.818 -176.416 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.634 ' O ' ' HA ' ' A' ' 55' ' ' MET . 0.1 OUTLIER -79.37 -36.46 39.22 Favored 'General case' 0 N--CA 1.436 -1.129 0 CA-C-N 114.504 -1.225 . . . . 0.0 111.876 -177.885 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.607 HG13 ' HG2' ' A' ' 13' ' ' ARG . 3.5 p -89.29 -18.63 7.75 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.087 0 O-C-N 121.973 -0.454 . . . . 0.0 111.896 -177.087 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.625 ' HA2' ' HB2' ' A' ' 52' ' ' LYS . . . 81.93 34.11 25.16 Favored Glycine 0 N--CA 1.428 -1.887 0 N-CA-C 111.924 -0.47 . . . . 0.0 111.924 -176.363 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.419 ' HB3' ' HB3' ' A' ' 42' ' ' LYS . 35.6 t80 -68.86 -42.43 77.08 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 123.055 0.542 . . . . 0.0 110.204 -179.341 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -86.96 126.43 34.71 Favored 'General case' 0 CA--C 1.498 -1.056 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 177.033 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.3 m -60.3 -36.26 77.47 Favored 'General case' 0 C--N 1.304 -1.38 0 CA-C-O 121.014 0.435 . . . . 0.0 112.079 -178.0 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 45.5 p90 -91.36 -7.67 50.2 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.586 -177.765 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.537 ' OD2' ' HG2' ' A' ' 43' ' ' LYS . 28.7 t70 -136.88 85.44 2.14 Favored 'General case' 0 CA--C 1.485 -1.552 0 CA-C-O 122.014 0.911 . . . . 0.0 110.439 -177.168 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.625 ' HB2' ' HA2' ' A' ' 46' ' ' GLY . 64.3 pttt -160.5 13.05 0.11 Allowed 'General case' 0 N--CA 1.432 -1.362 0 CA-C-N 113.73 -1.577 . . . . 0.0 112.768 -173.561 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 43.2 m-85 -68.64 -3.86 13.43 Favored 'General case' 0 C--N 1.287 -2.125 0 CA-C-O 121.932 0.872 . . . . 0.0 109.254 176.405 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.487 HE21 ' HE3' ' A' ' 43' ' ' LYS . 0.4 OUTLIER -112.45 17.34 19.38 Favored 'General case' 0 N--CA 1.403 -2.79 0 CA-C-N 114.887 -1.051 . . . . 0.0 109.47 -177.309 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 55' ' ' MET . . . . . 0.634 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 51.6 ttp -62.83 105.11 0.62 Allowed 'General case' 0 N--CA 1.413 -2.289 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.561 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 74.99 29.31 60.94 Favored Glycine 0 N--CA 1.437 -1.269 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.124 -176.703 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -102.79 154.25 19.36 Favored 'General case' 0 N--CA 1.444 -0.732 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 -177.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 29.7 pt20 -83.27 -17.26 43.2 Favored 'General case' 0 C--N 1.301 -1.525 0 CA-C-O 121.709 0.766 . . . . 0.0 109.986 -177.254 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 28.0 m-80 -61.18 -24.01 66.0 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 114.784 -1.098 . . . . 0.0 111.959 179.05 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 22.2 m -117.61 -21.4 4.85 Favored 'Isoleucine or valine' 0 CA--C 1.457 -2.633 0 N-CA-C 113.094 0.776 . . . . 0.0 113.094 -176.758 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . 0.311 2.4 p90 -33.73 102.38 0.21 Allowed Pre-proline 0 CA--C 1.545 0.766 0 O-C-N 126.179 2.174 . . . . 0.0 114.901 -159.963 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -75.15 102.44 1.59 Allowed 'Trans proline' 0 N--CA 1.426 -2.469 0 C-N-CA 122.9 2.4 . . . . 0.0 110.384 176.586 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -73.42 -144.12 0.68 Allowed Glycine 0 C--N 1.28 -2.555 0 CA-C-N 114.078 -1.419 . . . . 0.0 112.624 176.979 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_exo -56.98 133.57 58.82 Favored 'Trans proline' 0 C--O 1.246 0.897 0 C-N-CA 122.926 2.417 . . . . 0.0 112.417 -177.726 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.534 HD11 ' HB3' ' A' ' 100' ' ' LEU . 54.8 mt -62.16 114.02 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.361 0 CA-C-N 114.966 -1.016 . . . . 0.0 110.47 -177.689 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.473 ' HB2' ' SD ' ' A' ' 107' ' ' MET . 7.9 t70 -97.98 113.94 25.93 Favored 'General case' 0 CA--C 1.489 -1.381 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 173.463 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.444 ' O ' HD23 ' A' ' 71' ' ' LEU . 13.6 m120 -89.85 -15.06 33.04 Favored 'General case' 0 C--N 1.286 -2.167 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.672 178.868 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 6.0 m -53.03 -18.2 1.91 Allowed 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 114.995 1.479 . . . . 0.0 114.995 -168.87 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -76.65 -3.01 77.87 Favored Glycine 0 CA--C 1.527 0.81 0 C-N-CA 120.932 -0.651 . . . . 0.0 113.107 -178.771 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.423 HD21 ' HA ' ' A' ' 34' ' ' ASP . 39.5 mt -107.44 -17.39 14.13 Favored 'General case' 0 C--O 1.243 0.734 0 CA-C-O 122.253 1.025 . . . . 0.0 109.335 -179.344 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.444 HD23 ' O ' ' A' ' 67' ' ' ASN . 2.7 mm? -84.01 163.8 19.71 Favored 'General case' 0 N--CA 1.401 -2.918 0 CA-C-N 113.679 -1.6 . . . . 0.0 112.198 -173.22 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.8 mttt . . . . . 0 C--N 1.301 -1.51 0 CA-C-N 114.527 -1.215 . . . . 0.0 113.444 -178.324 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.5 -0.95 0 CA-C-O 120.936 0.398 . . . . 0.0 110.711 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLN . . . . . 0.712 ' HA ' HE21 ' A' ' 77' ' ' GLN . 0.0 OUTLIER -118.91 -1.2 11.05 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-O 121.809 0.814 . . . . 0.0 109.787 177.591 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 50.5 m -100.66 108.73 20.68 Favored 'General case' 0 C--N 1.281 -2.409 0 CA-C-N 114.407 -1.269 . . . . 0.0 111.137 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 87.1 mt -73.62 153.87 39.99 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.335 -178.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.443 ' HB2' ' CD1' ' A' ' 83' ' ' LEU . 98.9 mttt -78.78 165.83 23.13 Favored 'General case' 0 N--CA 1.426 -1.633 0 C-N-CA 119.734 -0.787 . . . . 0.0 109.202 170.579 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -82.46 -58.87 2.74 Favored 'General case' 0 C--N 1.285 -2.238 0 N-CA-C 113.799 1.037 . . . . 0.0 113.799 -171.901 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -74.96 12.57 0.83 Allowed 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 116.692 2.108 . . . . 0.0 116.692 -168.253 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.443 ' CD1' ' HB2' ' A' ' 80' ' ' LYS . 8.1 mp -73.78 169.11 18.04 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-O 121.547 0.689 . . . . 0.0 111.884 176.295 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.539 HG21 HD12 ' A' ' 87' ' ' LEU . 48.3 mt -137.33 166.88 24.19 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.575 0 N-CA-C 105.747 -1.945 . . . . 0.0 105.747 -178.013 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.572 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 65.9 t0 -56.24 -142.56 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.405 0 C-N-CA 126.498 1.919 . . . . 0.0 110.082 178.682 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.55 ' HA ' ' O ' ' A' ' 89' ' ' TYR . 7.5 pt-20 -39.09 -19.03 0.01 OUTLIER 'General case' 0 N--CA 1.533 3.694 0 N-CA-C 116.663 2.097 . . . . 0.0 116.663 -172.737 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.539 HD12 HG21 ' A' ' 84' ' ' ILE . 14.5 mt -67.87 -53.95 22.7 Favored 'General case' 0 C--N 1.281 -2.372 0 C-N-CA 123.891 0.876 . . . . 0.0 110.478 175.459 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -108.44 -30.85 8.08 Favored 'General case' 0 C--O 1.216 -0.667 0 CA-C-O 121.4 0.619 . . . . 0.0 110.993 -175.057 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' TYR . . . . . 0.572 ' CE1' ' HA ' ' A' ' 85' ' ' ASP . 8.7 p90 -142.32 -168.81 2.81 Favored 'General case' 0 C--O 1.173 -2.934 0 N-CA-C 104.738 -2.319 . . . . 0.0 104.738 177.542 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.679 ' O ' ' HA ' ' A' ' 32' ' ' LEU . 2.4 mt -144.7 141.07 23.7 Favored 'Isoleucine or valine' 0 CA--C 1.458 -2.578 0 CA-C-N 121.425 1.92 . . . . 0.0 109.47 173.638 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.502 ' CD2' ' HB3' ' A' ' 32' ' ' LEU . 77.9 mt -107.33 132.03 53.57 Favored 'General case' 0 C--N 1.274 -2.696 0 O-C-N 124.619 1.2 . . . . 0.0 110.792 176.739 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.401 HD12 ' N ' ' A' ' 92' ' ' LEU . 2.1 mp -141.67 156.65 66.15 Favored Pre-proline 0 C--N 1.276 -2.618 0 N-CA-C 106.8 -1.555 . . . . 0.0 106.8 -177.876 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.412 ' HD2' ' HB3' ' A' ' 19' ' ' LEU . 32.1 Cg_exo -61.23 167.77 8.77 Favored 'Trans proline' 0 C--O 1.26 1.578 0 C-N-CA 122.028 1.819 . . . . 0.0 110.218 174.738 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.463 ' HA ' ' CD1' ' A' ' 31' ' ' TYR . 32.4 m -49.86 -42.42 47.6 Favored 'General case' 0 C--N 1.306 -1.321 0 O-C-N 123.901 0.751 . . . . 0.0 110.231 176.527 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.492 ' O ' ' HG3' ' A' ' 99' ' ' LYS . 6.3 mm-40 -58.88 -50.34 74.39 Favored 'General case' 0 C--O 1.198 -1.609 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.89 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.581 ' O ' HD22 ' A' ' 100' ' ' LEU . . . -50.45 -58.11 9.49 Favored Glycine 0 CA--C 1.492 -1.362 0 O-C-N 124.153 0.908 . . . . 0.0 111.555 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 66.7 t-105 -54.65 -49.5 70.41 Favored 'General case' 0 C--N 1.311 -1.077 0 C-N-CA 123.169 0.588 . . . . 0.0 110.934 177.267 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -55.36 -31.11 61.5 Favored 'General case' 0 CA--C 1.496 -1.105 0 C-N-CA 123.088 0.555 . . . . 0.0 112.431 177.871 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.568 ' HE3' HD11 ' A' ' 19' ' ' LEU . 59.2 mttm -72.82 -51.4 19.04 Favored 'General case' 0 N--CA 1.411 -2.388 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 178.689 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.581 HD22 ' O ' ' A' ' 96' ' ' GLY . 0.6 OUTLIER -60.7 -39.25 87.83 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.426 0.632 . . . . 0.0 111.153 -179.563 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.551 ' HA ' ' HA ' ' A' ' 105' ' ' THR . 21.3 t -72.89 -28.14 26.32 Favored 'Isoleucine or valine' 0 N--CA 1.403 -2.823 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.774 177.514 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 18.6 t -76.04 -35.45 59.46 Favored 'General case' 0 C--N 1.297 -1.696 0 O-C-N 121.228 -0.92 . . . . 0.0 109.101 178.797 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' TRP . . . . . 0.54 ' CZ2' ' HB3' ' A' ' 99' ' ' LYS . 28.2 m0 -80.66 -48.44 12.61 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.02 -175.371 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -126.02 -2.14 7.1 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 114.185 1.18 . . . . 0.0 114.185 -177.118 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.551 ' HA ' ' HA ' ' A' ' 101' ' ' VAL 0.351 14.3 t 52.74 175.1 0.02 OUTLIER 'General case' 0 CA--C 1.509 -0.596 0 CA-C-O 123.688 1.708 . . . . 0.0 115.135 -175.59 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 54.4 tp -95.82 160.36 14.51 Favored 'General case' 1 C--N 1.231 -4.553 0 CA-C-N 111.941 -2.39 . . . . 0.0 107.072 -178.023 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' MET . . . . . 0.525 ' HG3' ' O ' ' A' ' 65' ' ' ILE . 37.3 mtp -68.62 155.67 39.58 Favored 'General case' 0 CA--C 1.487 -1.479 0 C-N-CA 119.045 -1.062 . . . . 0.0 108.811 175.311 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -84.43 132.53 34.56 Favored 'General case' 0 C--N 1.258 -3.379 0 CA-C-N 115.446 -0.797 . . . . 0.0 113.059 177.671 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 111.68 -37.37 3.72 Favored Glycine 0 N--CA 1.397 -3.908 0 CA-C-N 114.068 -1.424 . . . . 0.0 110.875 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -93.38 159.69 15.14 Favored 'General case' 0 N--CA 1.422 -1.857 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 178.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' GLU . . . . . 0.53 ' HB2' ' OE1' ' A' ' 77' ' ' GLN . 45.3 mt-10 -131.65 154.13 81.73 Favored Pre-proline 0 C--N 1.285 -2.223 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 -177.137 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -54.04 142.43 65.46 Favored 'Trans proline' 0 CA--C 1.458 -3.321 0 C-N-CA 124.13 3.22 . . . . 0.0 114.521 -175.264 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.477 ' O ' HD23 ' A' ' 32' ' ' LEU . 2.7 mp -100.51 113.8 37.38 Favored 'Isoleucine or valine' 1 N--CA 1.367 -4.604 0 CA-C-N 113.844 -1.526 . . . . 0.0 107.267 175.035 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -100.09 139.51 35.65 Favored 'General case' 0 C--N 1.281 -2.391 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.745 176.888 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.44 ' HB2' HD22 ' A' ' 32' ' ' LEU . 19.2 tpt180 -134.09 129.3 35.79 Favored 'General case' 0 C--N 1.293 -1.876 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 -177.682 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -79.58 163.29 24.76 Favored 'General case' 0 C--N 1.28 -2.435 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.677 177.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.478 HG21 ' O ' ' A' ' 25' ' ' ARG . 57.4 t . . . . . 0 C--N 1.311 -1.09 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.797 175.521 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.545 ' HB3' ' HG2' ' A' ' 12' ' ' GLN . . . . . . . . 0 N--CA 1.438 -1.036 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.649 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 9.8 t70 -71.32 140.36 50.24 Favored 'General case' 0 N--CA 1.427 -1.582 0 N-CA-C 106.746 -1.575 . . . . 0.0 106.746 173.821 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 65.0 mt -54.29 -40.79 68.22 Favored 'General case' 0 C--N 1.305 -1.353 0 CA-C-O 121.232 0.539 . . . . 0.0 110.482 -179.112 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -65.12 -39.9 93.74 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 114.318 -1.31 . . . . 0.0 110.033 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.422 ' HB ' ' HB3' ' A' ' 8' ' ' ASP . 2.3 m -66.75 -49.53 65.67 Favored 'General case' 0 N--CA 1.401 -2.877 0 CA-C-N 114.829 -1.078 . . . . 0.0 109.578 179.663 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.649 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 92.6 mt-30 -56.35 -44.87 80.52 Favored 'General case' 0 CA--C 1.474 -1.957 0 CA-C-N 114.914 -1.039 . . . . 0.0 111.225 -179.052 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.967 ' HD3' HG21 ' A' ' 45' ' ' VAL 0.268 10.3 mmm180 -69.56 -30.77 68.65 Favored 'General case' 0 N--CA 1.405 -2.685 0 N-CA-C 115.092 1.516 . . . . 0.0 115.092 -177.193 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.8 t -78.92 -46.21 18.89 Favored 'General case' 0 C--N 1.261 -3.279 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 179.831 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.519 ' O ' ' HB ' ' A' ' 18' ' ' THR . 11.1 t0 -59.83 -48.15 82.86 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 124.016 0.926 . . . . 0.0 109.624 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.621 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 12.4 mm -72.5 -39.07 61.56 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.207 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.611 -177.979 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.52 ' O ' ' HG2' ' A' ' 21' ' ' LYS . . . -57.94 -35.11 70.66 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 177.657 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.59 ' HA ' ' HE2' ' A' ' 21' ' ' LYS . 1.8 m -64.94 -43.39 92.89 Favored 'General case' 0 N--CA 1.399 -2.986 0 CA-C-N 114.183 -1.372 . . . . 0.0 111.786 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.554 ' HB3' ' CG ' ' A' ' 93' ' ' PRO . 88.8 mt -75.31 -12.87 60.36 Favored 'General case' 0 C--N 1.268 -2.955 0 N-CA-C 113.207 0.817 . . . . 0.0 113.207 -175.891 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.621 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 17.5 mt -86.22 -29.17 23.37 Favored 'General case' 0 C--N 1.309 -1.185 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 176.283 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.59 ' HE2' ' HA ' ' A' ' 18' ' ' THR . 54.4 pttt -96.32 -18.75 19.75 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-N 115.516 -0.766 . . . . 0.0 111.511 -175.186 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.6 m -53.46 131.71 38.61 Favored 'General case' 0 N--CA 1.399 -3.005 0 CA-C-O 122.251 1.024 . . . . 0.0 111.254 170.748 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 59.5 m -65.67 141.24 58.44 Favored 'General case' 0 N--CA 1.406 -2.634 0 CA-C-N 113.355 -1.748 . . . . 0.0 112.527 -178.867 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.412 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP . 0.4 OUTLIER -112.13 159.88 18.09 Favored 'General case' 0 N--CA 1.41 -2.455 0 CA-C-N 114.948 -1.023 . . . . 0.0 112.738 179.864 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 28.3 mmt85 -130.86 144.69 51.64 Favored 'General case' 0 C--N 1.288 -2.082 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.365 -177.79 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 18.0 pttm -66.12 97.03 0.35 Allowed 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 122.213 1.006 . . . . 0.0 109.56 177.009 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 147.43 -17.44 1.49 Allowed Glycine 0 N--CA 1.427 -1.909 0 CA-C-N 113.636 -1.62 . . . . 0.0 109.965 -172.84 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -77.42 145.65 37.04 Favored 'General case' 0 CA--C 1.499 -0.986 0 CA-C-O 120.855 0.36 . . . . 0.0 110.113 177.324 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.402 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 58.8 m -104.44 132.71 50.38 Favored 'General case' 0 C--N 1.293 -1.877 0 N-CA-C 107.518 -1.289 . . . . 0.0 107.518 176.172 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.412 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 22.6 m95 -121.83 143.8 49.2 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 -178.9 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.44 ' HB2' ' HB2' ' A' ' 97' ' ' TRP . 57.6 m-85 -107.04 141.03 38.92 Favored 'General case' 0 C--N 1.28 -2.452 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.842 -174.832 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.51 ' HA ' ' O ' ' A' ' 90' ' ' ILE . 5.9 mp -93.21 135.64 34.22 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 122.048 0.927 . . . . 0.0 112.799 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.501 HG23 HD23 ' A' ' 92' ' ' LEU . 73.7 t -116.14 136.8 51.94 Favored 'Isoleucine or valine' 0 C--N 1.28 -2.45 0 N-CA-C 105.776 -1.935 . . . . 0.0 105.776 171.478 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.523 ' OD1' ' HG2' ' A' ' 36' ' ' ARG . 19.7 t0 -63.19 126.94 29.06 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 169.008 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.566 ' OG ' ' HE3' ' A' ' 39' ' ' LYS . 48.4 t -67.88 -23.86 65.17 Favored 'General case' 0 C--N 1.287 -2.15 0 CA-C-N 115.311 -0.858 . . . . 0.0 109.831 -171.741 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.523 ' HG2' ' OD1' ' A' ' 34' ' ' ASP . 17.3 mmt-85 -62.24 -40.68 96.98 Favored 'General case' 0 C--O 1.239 0.52 0 N-CA-C 109.603 -0.518 . . . . 0.0 109.603 -178.168 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.454 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 51.4 t90 -68.34 -45.52 72.65 Favored 'General case' 0 C--O 1.227 -0.094 0 CA-C-N 115.304 -0.862 . . . . 0.0 108.784 179.197 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.519 ' CG ' HD12 ' A' ' 90' ' ' ILE . 17.8 t80 -65.65 -34.56 78.51 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.984 -177.06 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.566 ' HE3' ' OG ' ' A' ' 35' ' ' SER . 96.7 mttt -68.51 -32.73 72.89 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-O 120.707 0.289 . . . . 0.0 111.438 176.395 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.454 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 5.2 tp-100 -67.66 -41.61 83.5 Favored 'General case' 0 N--CA 1.412 -2.346 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 174.909 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.667 ' O ' HG22 ' A' ' 45' ' ' VAL . 52.8 t90 -65.67 -40.37 92.33 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 114.902 -1.044 . . . . 0.0 110.121 178.384 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.435 ' HD3' ' HA ' ' A' ' 39' ' ' LYS . 13.4 mtpp -52.06 -43.36 63.78 Favored 'General case' 0 C--O 1.216 -0.697 0 C-N-CA 124.408 1.083 . . . . 0.0 113.398 178.291 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 45.7 mttm -74.7 -40.89 61.07 Favored 'General case' 0 C--N 1.303 -1.422 0 C-N-CA 119.809 -0.756 . . . . 0.0 111.207 179.647 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.57 ' HB2' HG23 ' A' ' 60' ' ' VAL . 4.2 t80 -55.81 -33.92 64.88 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-N 114.389 -1.278 . . . . 0.0 111.933 179.752 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.967 HG21 ' HD3' ' A' ' 13' ' ' ARG . 3.4 m -94.41 -23.54 5.18 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.826 0 N-CA-C 112.608 0.595 . . . . 0.0 112.608 176.832 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.567 ' CA ' ' HG3' ' A' ' 52' ' ' LYS . . . 81.83 38.82 12.85 Favored Glycine 1 N--CA 1.391 -4.339 0 C-N-CA 120.033 -1.079 . . . . 0.0 110.498 -172.887 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.524 ' HB2' ' HE ' ' A' ' 13' ' ' ARG . 42.4 t80 -59.66 -49.4 77.89 Favored 'General case' 0 N--CA 1.433 -1.289 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 176.825 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -73.22 114.47 11.44 Favored 'General case' 0 N--CA 1.429 -1.519 0 CA-C-N 113.651 -1.613 . . . . 0.0 108.263 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 5.7 m -55.56 -27.44 49.09 Favored 'General case' 0 C--N 1.3 -1.571 0 C-N-CA 124.885 1.274 . . . . 0.0 113.206 -175.099 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 44.1 p90 -94.88 -0.91 53.61 Favored 'General case' 0 C--N 1.298 -1.661 0 O-C-N 122.153 -0.342 . . . . 0.0 111.097 -178.135 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -136.34 77.07 1.63 Allowed 'General case' 0 C--N 1.312 -1.028 0 C-N-CA 119.502 -0.879 . . . . 0.0 110.76 -173.58 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.567 ' HG3' ' CA ' ' A' ' 46' ' ' GLY . 0.0 OUTLIER -118.21 23.09 11.81 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-O 121.809 0.814 . . . . 0.0 111.523 177.029 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 74.4 m-85 -77.87 -22.59 49.56 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 176.855 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.463 ' HB3' HG11 ' A' ' 60' ' ' VAL . 13.8 mm-40 -95.57 -0.68 51.71 Favored 'General case' 0 N--CA 1.419 -2.02 0 C-N-CA 124.733 1.213 . . . . 0.0 110.283 -179.02 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 53.4 ttp -66.18 115.72 6.48 Favored 'General case' 0 N--CA 1.419 -1.994 0 CA-C-O 121.34 0.59 . . . . 0.0 110.672 -176.184 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 79.15 12.73 83.7 Favored Glycine 0 N--CA 1.437 -1.285 0 CA-C-N 115.065 -0.971 . . . . 0.0 111.512 -179.224 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.615 ' HB3' HG22 ' A' ' 60' ' ' VAL . 5.4 t70 -87.06 146.4 26.1 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 -177.527 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.447 ' O ' ' HD2' ' A' ' 61' ' ' TYR . 25.6 pt20 -83.82 -21.51 32.07 Favored 'General case' 0 C--N 1.285 -2.211 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.827 -177.905 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.9 m-80 -65.46 -22.86 66.8 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 121.654 0.74 . . . . 0.0 111.859 178.669 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.615 HG22 ' HB3' ' A' ' 57' ' ' ASP . 32.0 m -116.84 2.66 7.66 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.186 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.449 -173.965 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.447 ' HD2' ' O ' ' A' ' 58' ' ' GLN . 0.3 OUTLIER -68.78 118.32 59.68 Favored Pre-proline 0 C--N 1.313 -1.02 0 C-N-CA 120.115 -0.634 . . . . 0.0 109.969 -179.22 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -92.09 117.74 0.44 Allowed 'Trans proline' 0 N--CA 1.407 -3.563 0 C-N-CA 122.357 2.038 . . . . 0.0 110.455 176.103 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -74.54 -141.17 0.69 Allowed Glycine 0 C--N 1.268 -3.226 0 CA-C-N 114.158 -1.383 . . . . 0.0 111.949 175.593 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.523 ' HA ' ' O ' ' A' ' 104' ' ' TYR . 50.6 Cg_exo -53.69 131.56 44.65 Favored 'Trans proline' 0 C--O 1.251 1.133 0 C-N-CA 122.881 2.387 . . . . 0.0 113.041 -178.024 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 67.9 mt -60.99 122.76 12.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.381 -178.059 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -117.56 127.54 54.08 Favored 'General case' 0 C--N 1.297 -1.676 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.312 -179.574 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.477 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 93.5 m-20 -112.58 10.69 19.55 Favored 'General case' 0 C--N 1.301 -1.5 0 O-C-N 123.83 0.707 . . . . 0.0 111.104 -178.484 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 50.9 m -88.2 78.43 8.08 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 122.22 1.01 . . . . 0.0 111.621 -177.87 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 174.02 -37.77 0.12 Allowed Glycine 0 CA--C 1.48 -2.145 0 N-CA-C 104.91 -3.276 . . . . 0.0 104.91 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.486 HD11 ' HB3' ' A' ' 89' ' ' TYR . 28.8 tp -70.18 -45.6 66.37 Favored 'General case' 1 N--CA 1.374 -4.226 0 CA-C-N 112.221 -1.989 . . . . 0.0 107.769 168.866 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.541 ' O ' ' HE3' ' A' ' 80' ' ' LYS . 75.3 mt -71.05 159.75 34.16 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 114.643 -1.162 . . . . 0.0 109.64 175.254 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.401 ' HG2' ' HG2' ' A' ' 80' ' ' LYS . 41.8 mtpt . . . . . 0 C--N 1.323 -0.57 0 CA-C-O 120.776 0.322 . . . . 0.0 111.224 -178.328 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.435 ' HA ' HD13 ' A' ' 71' ' ' LEU . . . . . . . . 0 CA--C 1.512 -0.485 0 CA-C-O 121.768 0.794 . . . . 0.0 111.69 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 -130.02 2.78 4.81 Favored 'General case' 0 C--N 1.291 -1.937 0 N-CA-C 105.95 -1.87 . . . . 0.0 105.95 179.553 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.5 p -105.51 123.29 47.64 Favored 'General case' 0 C--N 1.293 -1.874 0 CA-C-N 114.107 -1.406 . . . . 0.0 113.074 -171.119 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.414 HD11 HG21 ' A' ' 113' ' ' ILE . 71.5 mt -93.72 138.54 31.82 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-O 120.736 0.303 . . . . 0.0 110.381 175.93 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.541 ' HE3' ' O ' ' A' ' 71' ' ' LEU . 99.1 mttt -72.35 139.87 48.15 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-O 121.32 0.581 . . . . 0.0 110.753 176.992 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -65.42 -18.17 65.1 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 122.011 0.91 . . . . 0.0 110.597 176.842 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 8.8 t-80 -82.82 -7.16 59.68 Favored 'General case' 0 C--N 1.296 -1.728 0 CA-C-N 114.169 -1.378 . . . . 0.0 110.676 -175.714 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.467 ' HG ' ' HB2' ' A' ' 80' ' ' LYS . 77.2 mt -76.35 130.48 38.14 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-O 121.148 0.499 . . . . 0.0 112.039 -175.613 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.675 HG21 HD12 ' A' ' 87' ' ' LEU . 50.9 mt -112.39 -179.37 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.29 -2.002 0 N-CA-C 105.645 -1.983 . . . . 0.0 105.645 173.813 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.651 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 13.0 t70 -63.83 -145.14 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.344 0 C-N-CA 124.737 1.215 . . . . 0.0 110.139 -179.342 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.593 ' HA ' ' O ' ' A' ' 89' ' ' TYR 0.254 0.0 OUTLIER -40.63 -17.69 0.01 OUTLIER 'General case' 0 N--CA 1.52 3.036 0 N-CA-C 117.006 2.225 . . . . 0.0 117.006 -175.147 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.675 HD12 HG21 ' A' ' 84' ' ' ILE . 43.4 mt -59.03 -52.48 65.56 Favored 'General case' 0 C--N 1.277 -2.579 0 C-N-CA 123.471 0.708 . . . . 0.0 109.782 170.526 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -112.59 -40.5 4.06 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.987 -176.439 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' TYR . . . . . 0.651 ' CE1' ' HA ' ' A' ' 85' ' ' ASP . 0.8 OUTLIER -135.74 178.43 7.05 Favored 'General case' 0 C--O 1.17 -3.097 0 C-N-CA 119.84 -0.744 . . . . 0.0 109.606 -179.983 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.519 HD12 ' CG ' ' A' ' 38' ' ' PHE . 6.8 mt -139.45 147.98 23.81 Favored 'Isoleucine or valine' 0 N--CA 1.404 -2.735 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 174.612 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.465 ' HA ' HD23 ' A' ' 91' ' ' LEU . 64.4 mt -109.72 129.54 55.6 Favored 'General case' 0 N--CA 1.399 -3.015 0 O-C-N 124.623 1.202 . . . . 0.0 111.008 178.026 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.501 HD23 HG23 ' A' ' 33' ' ' VAL . 1.5 mm? -123.43 150.03 59.74 Favored Pre-proline 0 C--N 1.27 -2.86 0 CA-C-N 113.419 -1.719 . . . . 0.0 106.47 -177.26 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.554 ' CG ' ' HB3' ' A' ' 19' ' ' LEU . 10.2 Cg_endo -64.95 168.34 13.94 Favored 'Trans proline' 0 N--CA 1.428 -2.332 0 N-CA-C 108.296 -1.463 . . . . 0.0 108.296 169.193 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 18.9 m -43.7 -48.12 7.88 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 123.667 0.604 . . . . 0.0 110.732 173.092 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -68.16 -36.39 79.55 Favored 'General case' 0 CA--C 1.485 -1.553 0 CA-C-N 115.509 -0.769 . . . . 0.0 112.401 -178.365 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -58.88 -57.89 17.45 Favored Glycine 0 N--CA 1.417 -2.632 0 N-CA-C 110.168 -1.173 . . . . 0.0 110.168 179.711 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.44 ' HB2' ' HB2' ' A' ' 31' ' ' TYR . 70.0 t-105 -54.63 -50.57 67.8 Favored 'General case' 0 N--CA 1.421 -1.893 0 C-N-CA 123.449 0.7 . . . . 0.0 110.611 174.822 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -50.59 -34.48 26.06 Favored 'General case' 0 C--O 1.215 -0.748 0 C-N-CA 123.029 0.532 . . . . 0.0 112.31 177.583 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 41.7 mttm -70.71 -50.02 40.79 Favored 'General case' 0 CA--C 1.456 -2.644 0 CA-C-O 120.862 0.363 . . . . 0.0 110.375 179.447 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.539 HD23 ' CE3' ' A' ' 103' ' ' TRP . 44.3 mt -65.64 -31.2 72.09 Favored 'General case' 0 C--N 1.264 -3.133 0 CA-C-N 115.078 -0.964 . . . . 0.0 111.804 -176.924 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.536 ' HA ' ' HA ' ' A' ' 105' ' ' THR . 12.7 t -81.06 -24.77 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.402 -2.847 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.319 174.752 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 37.6 t -76.35 -36.44 58.19 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 107.519 -1.289 . . . . 0.0 107.519 177.522 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' TRP . . . . . 0.539 ' CE3' HD23 ' A' ' 100' ' ' LEU . 50.0 m0 -80.9 -53.84 6.1 Favored 'General case' 0 N--CA 1.41 -2.445 0 CA-C-N 114.677 -1.147 . . . . 0.0 112.08 -177.16 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' TYR . . . . . 0.523 ' O ' ' HA ' ' A' ' 64' ' ' PRO . 41.6 m-85 -120.85 -3.38 9.7 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.521 -0.471 . . . . 0.0 112.187 -170.97 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.536 ' HA ' ' HA ' ' A' ' 101' ' ' VAL 0.265 7.2 t 50.02 -173.46 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.17 0 C-N-CA 126.591 1.956 . . . . 0.0 114.376 -174.132 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 44.9 tp -114.98 144.31 43.8 Favored 'General case' 0 C--N 1.256 -3.483 0 CA-C-N 113.578 -1.646 . . . . 0.0 109.458 -175.347 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' MET . . . . . 0.506 ' SD ' ' HB2' ' A' ' 64' ' ' PRO . 65.2 mmm -65.33 156.64 31.47 Favored 'General case' 0 C--O 1.247 0.958 0 CA-C-O 121.584 0.707 . . . . 0.0 110.928 176.682 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -79.83 138.04 37.11 Favored 'General case' 0 C--N 1.278 -2.541 0 CA-C-N 114.77 -1.105 . . . . 0.0 111.951 -176.736 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 101.63 -37.21 3.75 Favored Glycine 0 N--CA 1.415 -2.762 0 CA-C-N 114.754 -1.112 . . . . 0.0 110.384 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 24.5 mp0 -74.97 158.15 33.76 Favored 'General case' 0 CA--C 1.499 -0.991 0 CA-C-O 121.679 0.752 . . . . 0.0 112.043 178.31 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -116.83 157.57 45.96 Favored Pre-proline 0 N--CA 1.408 -2.536 0 N-CA-C 105.364 -2.087 . . . . 0.0 105.364 175.593 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' PRO . . . . . 0.433 ' HB3' ' CE2' ' A' ' 97' ' ' TRP . 13.8 Cg_exo -73.63 122.32 7.74 Favored 'Trans proline' 0 CA--C 1.451 -3.651 0 N-CA-C 108.047 -1.559 . . . . 0.0 108.047 166.858 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.414 HG21 HD11 ' A' ' 79' ' ' LEU . 3.6 mp -83.01 106.96 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.38 -3.956 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 -179.42 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 114' ' ' ALA . . . . . 0.406 ' O ' ' HD3' ' A' ' 115' ' ' ARG . . . -103.5 129.46 50.68 Favored 'General case' 0 N--CA 1.402 -2.841 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.861 -179.141 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.406 ' HD3' ' O ' ' A' ' 114' ' ' ALA . 21.9 mmt180 -131.23 -172.51 2.86 Favored 'General case' 0 C--N 1.286 -2.154 0 N-CA-C 105.475 -2.046 . . . . 0.0 105.475 177.787 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -130.11 176.35 8.16 Favored 'General case' 0 C--N 1.269 -2.911 0 C-N-CA 118.575 -1.25 . . . . 0.0 111.46 -177.561 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 61.6 t . . . . . 0 C--N 1.31 -1.118 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 173.63 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.458 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . . . . . . 0 CA--C 1.499 -0.989 0 CA-C-O 121.458 0.647 . . . . 0.0 110.207 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.577 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 4.8 p-10 -84.46 153.54 23.29 Favored 'General case' 0 CA--C 1.455 -2.708 0 C-N-CA 118.988 -1.085 . . . . 0.0 109.324 173.598 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.484 ' O ' ' HG3' ' A' ' 13' ' ' ARG . 3.9 mm? -47.5 -46.16 27.01 Favored 'General case' 0 C--N 1.286 -2.19 0 C-N-CA 125.757 1.623 . . . . 0.0 112.1 -178.695 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -67.78 -36.66 80.85 Favored 'General case' 0 C--N 1.257 -3.419 0 CA-C-N 113.064 -1.88 . . . . 0.0 110.273 -177.849 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.458 ' CG2' ' HB1' ' A' ' 7' ' ' ALA . 1.7 m -67.82 -50.21 58.02 Favored 'General case' 0 N--CA 1.395 -3.189 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.393 176.676 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.577 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 87.8 mt-30 -50.92 -53.4 33.15 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 124.0 0.812 . . . . 0.0 111.387 -175.97 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.651 ' HG2' HG13 ' A' ' 45' ' ' VAL . 28.9 mtm180 -48.56 -60.04 3.02 Favored 'General case' 0 N--CA 1.487 1.416 0 CA-C-O 122.137 0.97 . . . . 0.0 110.676 176.777 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.9 m -65.26 -43.51 91.08 Favored 'General case' 0 N--CA 1.424 -1.727 0 CA-C-N 113.379 -1.737 . . . . 0.0 113.091 -171.334 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -68.22 -36.08 78.97 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.451 -176.142 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.511 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 22.9 mm -78.79 -37.77 20.65 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.158 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.248 177.253 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.2 -43.23 92.24 Favored 'General case' 0 CA--C 1.492 -1.279 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 179.689 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.41 ' O ' ' HB ' ' A' ' 22' ' ' THR . 2.3 m -55.43 -39.98 70.94 Favored 'General case' 0 N--CA 1.403 -2.775 0 C-N-CA 125.504 1.522 . . . . 0.0 111.543 178.189 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 78.5 mt -84.29 -13.89 51.25 Favored 'General case' 0 C--N 1.295 -1.799 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -174.381 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 59.7 mt -81.58 -17.54 47.97 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 175.85 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -104.01 -41.44 5.85 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.156 -1.384 . . . . 0.0 111.424 -175.035 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.41 ' HB ' ' O ' ' A' ' 18' ' ' THR . 1.4 t -46.31 167.29 0.02 OUTLIER 'General case' 0 C--O 1.242 0.702 0 C-N-CA 126.35 1.86 . . . . 0.0 114.81 -179.878 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 61.5 m -61.25 127.06 29.68 Favored 'General case' 0 N--CA 1.389 -3.502 0 CA-C-N 111.697 -2.501 . . . . 0.0 112.286 179.414 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.546 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP . 0.3 OUTLIER -111.7 -18.49 12.75 Favored 'General case' 0 C--N 1.283 -2.289 0 CA-C-N 113.797 -1.547 . . . . 0.0 113.116 -177.969 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.626 ' O ' HG11 ' A' ' 117' ' ' VAL . 9.9 mtm180 60.17 -152.67 0.39 Allowed 'General case' 0 C--N 1.253 -3.627 0 CA-C-N 112.838 -1.983 . . . . 0.0 109.09 -178.314 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 57.7 mtmt -126.43 29.02 5.85 Favored 'General case' 0 C--N 1.292 -1.91 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 172.638 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -153.3 33.33 0.78 Allowed Glycine 0 N--CA 1.435 -1.368 0 CA-C-N 114.33 -1.305 . . . . 0.0 113.074 -179.084 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.48 ' H ' HG23 ' A' ' 117' ' ' VAL . 7.9 t70 -109.56 173.45 6.32 Favored 'General case' 0 N--CA 1.484 1.264 0 N-CA-C 106.954 -1.498 . . . . 0.0 106.954 177.891 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.406 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 85.9 m -122.19 121.19 36.27 Favored 'General case' 0 C--N 1.282 -2.331 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.546 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 17.4 m95 -103.31 126.74 50.63 Favored 'General case' 0 N--CA 1.388 -3.564 0 CA-C-N 114.662 -1.153 . . . . 0.0 109.388 -179.249 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.446 ' HB2' ' HB2' ' A' ' 97' ' ' TRP . 82.8 m-85 -98.38 144.47 27.72 Favored 'General case' 0 C--N 1.272 -2.782 0 CA-C-N 115.065 -0.971 . . . . 0.0 110.975 -175.567 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.55 ' CD1' HD21 ' A' ' 91' ' ' LEU . 6.1 mp -93.5 141.9 27.95 Favored 'General case' 0 N--CA 1.426 -1.665 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.971 -177.254 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.547 ' CG1' ' HB ' ' A' ' 90' ' ' ILE . 0.6 OUTLIER -133.11 142.24 42.62 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.756 0 CA-C-N 114.377 -1.283 . . . . 0.0 108.365 174.963 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.482 ' OD1' ' HB2' ' A' ' 36' ' ' ARG . 10.5 t70 -61.13 128.98 39.08 Favored 'General case' 0 C--N 1.305 -1.349 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 176.205 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.507 ' O ' ' HD3' ' A' ' 39' ' ' LYS . 19.5 p -61.58 -34.86 76.33 Favored 'General case' 0 C--O 1.209 -1.028 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 -173.721 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.482 ' HB2' ' OD1' ' A' ' 34' ' ' ASP . 0.0 OUTLIER -64.13 -36.7 84.88 Favored 'General case' 0 CA--C 1.482 -1.667 0 CA-C-O 121.23 0.538 . . . . 0.0 111.204 -176.564 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.509 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 51.1 t90 -63.32 -44.04 96.08 Favored 'General case' 0 C--N 1.287 -2.131 0 CA-C-N 113.992 -1.458 . . . . 0.0 108.266 178.164 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -69.64 -43.17 73.17 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.829 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.507 ' HD3' ' O ' ' A' ' 35' ' ' SER . 14.6 mptt -55.38 -32.74 62.86 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 122.601 0.361 . . . . 0.0 111.937 171.89 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.509 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 62.6 tp60 -72.32 -46.62 54.82 Favored 'General case' 0 N--CA 1.419 -2.016 0 C-N-CA 123.22 0.608 . . . . 0.0 109.464 176.727 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 72.6 t90 -58.4 -39.22 79.11 Favored 'General case' 0 C--O 1.213 -0.821 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.871 177.73 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.517 ' HG2' ' CD1' ' A' ' 47' ' ' PHE . 15.3 mtpp -56.39 -40.0 73.89 Favored 'General case' 0 N--CA 1.44 -0.942 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.428 ' HB3' ' HG3' ' A' ' 54' ' ' GLN . 39.6 mttp -72.31 -44.67 62.37 Favored 'General case' 0 C--N 1.293 -1.87 0 CA-C-O 121.133 0.492 . . . . 0.0 110.25 177.478 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.688 ' HB2' HG23 ' A' ' 60' ' ' VAL . 1.0 OUTLIER -58.12 -39.1 77.83 Favored 'General case' 0 N--CA 1.418 -2.072 0 CA-C-N 114.524 -1.217 . . . . 0.0 110.948 -179.226 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.651 HG13 ' HG2' ' A' ' 13' ' ' ARG . 2.6 p -92.25 -23.62 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.387 -3.615 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -175.944 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.562 ' HA2' ' HG3' ' A' ' 52' ' ' LYS . . . 93.07 22.85 26.54 Favored Glycine 0 N--CA 1.433 -1.535 0 C-N-CA 120.077 -1.059 . . . . 0.0 111.14 -175.249 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.545 ' HB2' ' CG1' ' A' ' 45' ' ' VAL . 20.1 t80 -78.87 -30.81 45.23 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 177.298 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -76.57 111.75 12.39 Favored 'General case' 0 CA--C 1.483 -1.598 0 N-CA-C 106.096 -1.816 . . . . 0.0 106.096 173.254 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 2.5 p -65.27 -19.72 66.09 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 113.065 0.765 . . . . 0.0 113.065 -175.218 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 42.1 p90 -97.69 -0.47 45.46 Favored 'General case' 0 C--N 1.286 -2.195 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.446 178.463 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.432 ' OD1' ' HG2' ' A' ' 54' ' ' GLN . 20.4 t0 -141.63 91.9 2.41 Favored 'General case' 0 CA--C 1.491 -1.318 0 C-N-CA 118.738 -1.185 . . . . 0.0 111.208 -176.593 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.562 ' HG3' ' HA2' ' A' ' 46' ' ' GLY . 0.1 OUTLIER -121.77 18.86 11.07 Favored 'General case' 0 C--N 1.291 -1.939 0 CA-C-O 121.639 0.733 . . . . 0.0 110.541 175.836 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -78.91 -33.36 45.59 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 176.525 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.484 ' HB3' HG11 ' A' ' 60' ' ' VAL . 7.8 mm-40 -81.76 -3.85 54.86 Favored 'General case' 0 N--CA 1.42 -1.973 0 CA-C-N 113.854 -1.521 . . . . 0.0 110.863 -177.139 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' MET . . . . . 0.57 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 46.6 ttm -62.63 114.83 3.8 Favored 'General case' 0 N--CA 1.421 -1.918 0 C-N-CA 123.115 0.566 . . . . 0.0 111.149 -177.785 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.01 5.66 89.47 Favored Glycine 0 N--CA 1.434 -1.481 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.994 179.301 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -81.38 141.18 34.22 Favored 'General case' 0 CA--C 1.496 -1.122 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 -177.386 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.554 ' O ' ' HD2' ' A' ' 61' ' ' TYR . 11.9 pt20 -78.72 -20.34 50.28 Favored 'General case' 0 C--N 1.277 -2.567 0 CA-C-N 114.926 -1.033 . . . . 0.0 109.332 177.835 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -58.18 -29.97 66.06 Favored 'General case' 0 CA--C 1.497 -1.082 0 CA-C-O 121.939 0.876 . . . . 0.0 111.064 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.688 HG23 ' HB2' ' A' ' 44' ' ' TYR . 21.7 m -115.29 2.3 8.04 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.998 0 CA-C-N 114.744 -1.116 . . . . 0.0 112.253 -171.297 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.554 ' HD2' ' O ' ' A' ' 58' ' ' GLN . 1.8 p90 -54.51 116.68 11.36 Favored Pre-proline 0 C--N 1.306 -1.307 0 O-C-N 124.373 1.045 . . . . 0.0 111.594 -175.819 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 61' ' ' TYR . 9.0 Cg_endo -87.92 109.17 0.63 Allowed 'Trans proline' 0 N--CA 1.426 -2.469 0 C-N-CA 122.763 2.309 . . . . 0.0 109.833 176.456 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -74.28 -141.19 0.65 Allowed Glycine 0 C--N 1.283 -2.38 0 CA-C-N 114.662 -1.154 . . . . 0.0 113.023 177.881 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.64 129.16 33.57 Favored 'Trans proline' 0 C--O 1.24 0.584 0 C-N-CA 123.04 2.493 . . . . 0.0 113.346 -176.592 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.584 HD11 ' HB3' ' A' ' 100' ' ' LEU . 47.6 mt -65.55 114.17 2.71 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.067 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.469 -178.719 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -108.36 127.53 53.96 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-O 120.775 0.321 . . . . 0.0 110.502 178.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 18.6 m-80 -113.09 6.37 17.56 Favored 'General case' 0 C--N 1.302 -1.487 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.396 -176.693 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 12.1 t -53.8 -32.99 54.63 Favored 'General case' 0 CA--C 1.557 1.233 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 -174.355 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -73.96 -14.79 79.99 Favored Glycine 0 CA--C 1.525 0.691 0 C-N-CA 121.202 -0.523 . . . . 0.0 112.703 -179.275 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 61.6 mt -89.67 -15.56 32.37 Favored 'General case' 0 C--O 1.243 0.755 0 CA-C-O 121.949 0.881 . . . . 0.0 109.273 -179.451 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.633 ' HA ' ' HA ' ' A' ' 79' ' ' LEU . 74.9 mt -86.45 161.44 18.63 Favored 'General case' 0 C--N 1.292 -1.929 0 CA-C-N 114.863 -1.062 . . . . 0.0 112.065 -173.005 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt . . . . . 0 C--N 1.308 -1.199 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 178.443 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.491 ' HA ' HD13 ' A' ' 71' ' ' LEU . . . . . . . . 0 C--O 1.22 -0.489 0 CA-C-O 122.135 0.969 . . . . 0.0 110.969 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 -114.82 -1.95 13.07 Favored 'General case' 0 C--N 1.286 -2.18 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 178.212 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.8 m -93.87 107.01 18.95 Favored 'General case' 0 C--N 1.296 -1.76 0 CA-C-N 114.247 -1.342 . . . . 0.0 108.541 -177.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.633 ' HA ' ' HA ' ' A' ' 71' ' ' LEU . 1.5 pp -107.91 154.76 21.13 Favored 'General case' 0 C--N 1.292 -1.925 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.433 -174.886 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.473 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 50.3 mtmt -66.27 112.38 3.95 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 122.052 0.929 . . . . 0.0 111.007 179.194 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -60.12 -27.85 67.38 Favored 'General case' 0 C--N 1.298 -1.656 0 C-N-CA 124.979 1.312 . . . . 0.0 112.781 -173.029 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 33.0 m170 -91.96 11.58 24.62 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 112.43 0.53 . . . . 0.0 112.43 -175.672 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 80' ' ' LYS . 61.5 mt -77.36 133.95 38.59 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-O 121.007 0.432 . . . . 0.0 111.266 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 42.8 mt -81.0 164.15 3.11 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.179 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 177.788 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.742 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 5.3 p-10 -64.39 -110.87 0.0 OUTLIER 'General case' 0 C--O 1.19 -2.079 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -176.959 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -44.11 -29.67 0.65 Allowed 'General case' 0 CA--C 1.557 1.232 0 C-N-CA 127.946 2.498 . . . . 0.0 113.466 -177.658 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 22.9 mt -72.57 -57.59 4.03 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.283 -178.721 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -86.55 -29.45 22.65 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.637 -176.044 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' TYR . . . . . 0.742 ' CE1' ' HA ' ' A' ' 85' ' ' ASP . 7.8 p90 -155.94 -163.06 1.41 Allowed 'General case' 0 C--O 1.194 -1.853 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 -175.386 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.547 ' HB ' ' CG1' ' A' ' 33' ' ' VAL . 0.6 OUTLIER -136.74 148.48 26.79 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.085 0 N-CA-C 106.673 -1.603 . . . . 0.0 106.673 167.138 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.55 HD21 ' CD1' ' A' ' 32' ' ' LEU . 15.9 mt -107.33 123.49 48.42 Favored 'General case' 1 N--CA 1.367 -4.612 0 O-C-N 124.55 1.156 . . . . 0.0 109.24 169.688 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.464 HD13 HD23 ' A' ' 100' ' ' LEU . 12.0 mt -118.12 146.87 40.25 Favored Pre-proline 0 C--N 1.283 -2.318 0 N-CA-C 106.315 -1.735 . . . . 0.0 106.315 -178.098 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -71.17 169.56 20.34 Favored 'Trans proline' 0 C--O 1.259 1.574 0 C-N-CA 121.974 1.783 . . . . 0.0 108.109 176.157 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.593 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 98.6 m -38.96 -52.2 1.79 Allowed 'General case' 0 CA--C 1.543 0.675 0 O-C-N 123.991 0.807 . . . . 0.0 111.707 178.082 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -72.66 -30.95 64.71 Favored 'General case' 0 CA--C 1.498 -1.021 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 -175.824 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.614 ' O ' HD22 ' A' ' 100' ' ' LEU . . . -62.75 -55.05 29.21 Favored Glycine 0 N--CA 1.43 -1.722 0 N-CA-C 109.158 -1.577 . . . . 0.0 109.158 178.102 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.446 ' HB2' ' HB2' ' A' ' 31' ' ' TYR . 68.5 t-105 -58.79 -49.82 76.25 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 123.752 0.821 . . . . 0.0 110.047 178.777 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.593 ' HB2' ' O ' ' A' ' 94' ' ' THR . 5.9 t-20 -48.52 -44.33 36.05 Favored 'General case' 0 C--O 1.207 -1.174 0 C-N-CA 124.909 1.283 . . . . 0.0 110.11 179.096 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -66.84 -51.82 51.03 Favored 'General case' 0 N--CA 1.423 -1.797 0 CA-C-O 119.16 -0.447 . . . . 0.0 111.458 178.977 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.614 HD22 ' O ' ' A' ' 96' ' ' GLY . 0.4 OUTLIER -59.47 -34.51 72.64 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 121.396 0.617 . . . . 0.0 112.071 179.929 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.507 ' HA ' ' HA ' ' A' ' 105' ' ' THR . 24.0 t -78.0 -27.34 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.378 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.969 178.183 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 73.8 m -78.87 -32.08 45.79 Favored 'General case' 0 C--N 1.291 -1.969 0 O-C-N 121.08 -1.013 . . . . 0.0 109.022 176.424 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' TRP . . . . . . . . . . . . . 50.6 m0 -79.88 -49.78 11.43 Favored 'General case' 0 N--CA 1.423 -1.792 0 CA-C-N 115.428 -0.805 . . . . 0.0 112.316 -177.772 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -129.92 5.06 4.96 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -175.318 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.507 ' HA ' ' HA ' ' A' ' 101' ' ' VAL 0.321 13.6 t 49.63 -176.5 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 123.876 1.798 . . . . 0.0 115.268 -176.926 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.426 HD13 ' CH2' ' A' ' 97' ' ' TRP . 37.0 tp -104.56 156.33 18.05 Favored 'General case' 1 C--N 1.23 -4.623 0 CA-C-N 112.022 -2.354 . . . . 0.0 107.251 -175.982 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 32.6 tpp -69.38 132.58 46.6 Favored 'General case' 1 N--CA 1.366 -4.633 0 CA-C-O 122.353 1.073 . . . . 0.0 110.294 178.559 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -63.92 136.87 57.72 Favored 'General case' 0 C--N 1.251 -3.677 0 CA-C-N 112.29 -2.232 . . . . 0.0 111.15 -176.093 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 93.64 -18.04 57.31 Favored Glycine 0 N--CA 1.416 -2.684 0 CA-C-N 114.99 -1.005 . . . . 0.0 112.533 179.7 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -113.88 127.33 55.94 Favored 'General case' 1 N--CA 1.362 -4.866 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 -179.581 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 -98.36 153.32 38.08 Favored Pre-proline 0 C--N 1.301 -1.536 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 -179.518 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_exo -48.49 129.36 19.66 Favored 'Trans proline' 0 CA--C 1.485 -1.953 0 C-N-CA 124.397 3.398 . . . . 0.0 115.985 -174.395 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.44 ' N ' HD12 ' A' ' 113' ' ' ILE . 3.1 mp -92.4 108.95 20.83 Favored 'Isoleucine or valine' 0 N--CA 1.384 -3.732 0 CA-C-N 111.796 -2.456 . . . . 0.0 105.764 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 114' ' ' ALA . . . . . 0.406 ' HB1' ' CG2' ' A' ' 29' ' ' THR . . . -118.6 149.89 40.6 Favored 'General case' 0 C--N 1.292 -1.901 0 N-CA-C 114.02 1.119 . . . . 0.0 114.02 -173.864 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 81.8 mtt180 -135.61 167.1 21.74 Favored 'General case' 0 CA--C 1.47 -2.113 0 C-N-CA 125.873 1.669 . . . . 0.0 107.121 172.181 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -101.33 176.02 5.38 Favored 'General case' 0 C--N 1.262 -3.234 0 C-N-CA 118.536 -1.266 . . . . 0.0 110.902 179.424 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.626 HG11 ' O ' ' A' ' 25' ' ' ARG . 48.3 t . . . . . 0 C--O 1.241 0.625 0 CA-C-O 122.687 1.232 . . . . 0.0 112.495 -176.166 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.488 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . . . . . . 0 CA--C 1.496 -1.112 0 CA-C-O 121.371 0.605 . . . . 0.0 111.34 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.652 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 13.3 t70 -64.19 143.06 58.17 Favored 'General case' 0 CA--C 1.48 -1.724 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.072 171.353 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -40.3 -56.83 1.88 Allowed 'General case' 0 C--N 1.299 -1.595 0 C-N-CA 126.422 1.889 . . . . 0.0 112.407 176.569 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -73.66 -25.66 60.37 Favored 'General case' 0 C--N 1.27 -2.879 0 CA-C-N 114.682 -1.144 . . . . 0.0 110.771 -174.535 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.526 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 2.2 m -68.31 -44.98 74.19 Favored 'General case' 0 N--CA 1.398 -3.064 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 175.553 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.652 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 75.1 mt-30 -55.41 -61.62 2.22 Favored 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 123.761 0.825 . . . . 0.0 112.484 -175.751 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.477 ' HB3' HG13 ' A' ' 45' ' ' VAL . 1.4 ptm180 -51.23 -41.56 60.4 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 121.373 0.606 . . . . 0.0 112.32 179.125 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.6 m -72.53 -44.25 62.43 Favored 'General case' 0 C--N 1.291 -1.954 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.792 -176.395 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -76.04 -19.6 58.49 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.144 -174.406 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.607 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 27.4 mm -87.71 -31.07 5.71 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.159 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.024 176.242 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.466 ' O ' ' HG3' ' A' ' 21' ' ' LYS . . . -59.36 -35.09 73.24 Favored 'General case' 0 CA--C 1.498 -1.029 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 -177.828 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 7.3 m -53.8 -53.32 54.04 Favored 'General case' 0 N--CA 1.415 -2.181 0 C-N-CA 126.506 1.922 . . . . 0.0 111.048 176.715 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.657 ' HB3' ' HD2' ' A' ' 93' ' ' PRO . 1.6 mm? -72.1 -15.23 62.0 Favored 'General case' 1 N--CA 1.356 -5.141 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 179.951 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.607 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 11.9 mt -86.03 -24.1 26.53 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-O 121.929 0.871 . . . . 0.0 109.617 177.824 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.466 ' HG3' ' O ' ' A' ' 17' ' ' ALA . 0.1 OUTLIER -90.9 -4.12 56.79 Favored 'General case' 0 CA--C 1.5 -0.98 0 CA-C-O 122.33 1.062 . . . . 0.0 111.521 -174.25 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 32.0 m -90.07 141.44 28.67 Favored 'General case' 0 N--CA 1.389 -3.49 0 CA-C-N 113.557 -1.656 . . . . 0.0 111.048 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.1 m -108.62 166.26 10.93 Favored 'General case' 0 N--CA 1.399 -2.977 0 CA-C-N 113.734 -1.575 . . . . 0.0 110.743 178.667 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.512 HD13 ' H ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -108.06 167.03 10.28 Favored 'General case' 1 N--CA 1.36 -4.936 0 CA-C-N 113.121 -1.854 . . . . 0.0 114.111 -170.897 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.645 ' O ' HG21 ' A' ' 117' ' ' VAL . 0.0 OUTLIER -126.83 159.86 32.63 Favored 'General case' 0 C--N 1.261 -3.251 0 CA-C-N 111.423 -2.626 . . . . 0.0 104.873 -178.821 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -67.6 132.6 47.85 Favored 'General case' 0 C--N 1.289 -2.063 0 CA-C-N 117.939 0.336 . . . . 0.0 110.983 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 99.01 -2.7 58.21 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.864 -0.684 . . . . 0.0 113.559 176.799 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.564 ' OD2' ' HB2' ' A' ' 25' ' ' ARG . 8.3 m-20 -86.77 155.51 20.3 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 117.18 0.49 . . . . 0.0 112.179 -177.672 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.428 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 41.3 m -108.67 136.56 48.04 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.3 -178.692 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.475 ' CZ2' HD12 ' A' ' 24' ' ' LEU . 36.4 m95 -122.46 153.89 38.53 Favored 'General case' 0 N--CA 1.429 -1.515 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 176.926 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -106.56 129.35 54.52 Favored 'General case' 0 C--N 1.273 -2.729 0 CA-C-O 120.992 0.425 . . . . 0.0 110.246 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.665 HD11 ' CG ' ' A' ' 89' ' ' TYR . 27.1 tp -90.0 128.98 36.38 Favored 'General case' 1 N--CA 1.367 -4.625 0 CA-C-N 114.335 -1.302 . . . . 0.0 113.039 -177.229 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.403 HG12 ' O ' ' A' ' 34' ' ' ASP . 55.3 t -118.09 139.77 44.02 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.012 0 C-N-CA 126.111 1.765 . . . . 0.0 108.743 -178.646 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.587 ' OD2' ' HB2' ' A' ' 36' ' ' ARG . 10.9 t70 -64.73 123.53 19.58 Favored 'General case' 0 C--N 1.299 -1.615 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 169.812 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.4 t -65.6 -27.55 68.49 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 120.989 0.423 . . . . 0.0 109.883 -172.564 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.587 ' HB2' ' OD2' ' A' ' 34' ' ' ASP . 67.8 mtt85 -66.95 -34.95 78.9 Favored 'General case' 0 C--O 1.243 0.752 0 C-N-CA 123.459 0.704 . . . . 0.0 110.236 -177.608 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 69.7 t90 -71.34 -46.25 60.99 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 175.684 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 30.3 t80 -58.6 -41.44 85.83 Favored 'General case' 0 CA--C 1.549 0.937 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.979 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.575 ' O ' ' HG3' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -51.32 -48.87 62.23 Favored 'General case' 0 CA--C 1.489 -1.395 0 CA-C-N 118.231 0.468 . . . . 0.0 111.178 173.075 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.406 ' HG3' ' O ' ' A' ' 60' ' ' VAL . 5.7 tp-100 -60.12 -43.92 95.29 Favored 'General case' 0 N--CA 1.409 -2.498 0 O-C-N 123.796 0.685 . . . . 0.0 110.634 -177.101 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 76.5 t90 -61.07 -39.99 91.97 Favored 'General case' 0 C--O 1.214 -0.77 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.451 178.526 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.508 ' HD3' ' HA ' ' A' ' 39' ' ' LYS . 14.4 mtpp -60.1 -41.0 91.57 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-O 120.927 0.394 . . . . 0.0 111.742 -178.494 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.575 ' HG3' ' O ' ' A' ' 39' ' ' LYS . 18.3 mtpp -73.57 -39.06 64.94 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 -175.316 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.688 ' HB2' HG23 ' A' ' 60' ' ' VAL . 0.2 OUTLIER -67.41 -44.34 79.03 Favored 'General case' 0 N--CA 1.428 -1.543 0 CA-C-N 114.173 -1.376 . . . . 0.0 111.205 -179.654 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.477 HG13 ' HB3' ' A' ' 13' ' ' ARG . 2.3 p -85.14 -12.34 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.608 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.323 -174.85 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 66.33 43.15 93.39 Favored Glycine 0 N--CA 1.44 -1.086 0 N-CA-C 109.879 -1.288 . . . . 0.0 109.879 -175.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.466 ' HB2' ' CG1' ' A' ' 45' ' ' VAL . 88.2 t80 -64.82 -40.51 95.32 Favored 'General case' 0 N--CA 1.437 -1.111 0 C-N-CA 123.802 0.841 . . . . 0.0 108.976 -179.039 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.462 ' O ' ' HB2' ' A' ' 52' ' ' LYS . 7.4 m-20 -95.64 132.74 40.48 Favored 'General case' 0 C--N 1.298 -1.639 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 179.253 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.2 m -69.11 -22.44 63.97 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-O 121.488 0.661 . . . . 0.0 111.982 -179.465 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 38.7 p90 -99.3 2.3 45.34 Favored 'General case' 0 C--N 1.302 -1.489 0 C-N-CA 123.512 0.725 . . . . 0.0 110.379 -177.651 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.499 ' OD2' ' HG2' ' A' ' 43' ' ' LYS . 14.9 t70 -150.18 73.15 1.14 Allowed 'General case' 0 CA--C 1.472 -2.03 0 N-CA-C 103.608 -2.738 . . . . 0.0 103.608 -176.634 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 48' ' ' ASP 0.386 53.4 tptt -142.57 13.89 1.95 Allowed 'General case' 0 N--CA 1.393 -3.3 0 CA-C-N 110.661 -2.972 . . . . 0.0 109.237 -157.733 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 59.7 m-85 -99.36 -13.28 19.67 Favored 'General case' 0 C--N 1.293 -1.88 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.435 -173.332 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.545 ' HB3' HG11 ' A' ' 60' ' ' VAL . 43.0 mt-30 -97.94 6.98 47.08 Favored 'General case' 0 N--CA 1.426 -1.644 0 N-CA-C 107.961 -1.125 . . . . 0.0 107.961 176.605 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' MET . . . . . 0.526 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 56.7 ttp -63.63 116.02 5.27 Favored 'General case' 0 N--CA 1.412 -2.352 0 CA-C-N 114.795 -1.093 . . . . 0.0 109.848 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.73 18.26 75.73 Favored Glycine 0 N--CA 1.429 -1.796 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.612 -179.192 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.59 ' HB3' HG22 ' A' ' 60' ' ' VAL . 9.3 t0 -94.34 143.95 25.96 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 179.313 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.451 ' O ' ' HD2' ' A' ' 61' ' ' TYR . 13.7 pt20 -84.3 -15.79 45.37 Favored 'General case' 0 C--N 1.291 -1.95 0 CA-C-O 122.007 0.908 . . . . 0.0 110.647 -179.198 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 -64.71 -28.06 69.34 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-N 114.659 -1.155 . . . . 0.0 111.217 177.819 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.688 HG23 ' HB2' ' A' ' 44' ' ' TYR . 33.2 m -115.65 1.82 8.12 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.099 0 CA-C-N 114.952 -1.022 . . . . 0.0 112.089 -172.038 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.451 ' HD2' ' O ' ' A' ' 58' ' ' GLN . 0.8 OUTLIER -64.87 118.13 45.68 Favored Pre-proline 0 C--N 1.307 -1.266 0 C-N-CA 119.638 -0.825 . . . . 0.0 109.696 -178.988 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 61' ' ' TYR . 18.4 Cg_endo -87.46 113.8 0.95 Allowed 'Trans proline' 0 N--CA 1.412 -3.282 0 C-N-CA 122.429 2.086 . . . . 0.0 109.828 177.996 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -73.26 -134.35 0.23 Allowed Glycine 0 C--N 1.275 -2.816 0 CA-C-N 114.233 -1.348 . . . . 0.0 112.105 177.115 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -56.65 131.06 43.31 Favored 'Trans proline' 0 CA--C 1.502 -1.108 0 C-N-CA 122.518 2.146 . . . . 0.0 112.357 -177.243 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.528 ' O ' HD23 ' A' ' 106' ' ' LEU . 96.2 mt -58.56 112.44 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.551 0 CA-C-N 114.365 -1.288 . . . . 0.0 109.505 177.185 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -106.86 103.45 12.89 Favored 'General case' 0 C--N 1.288 -2.095 0 N-CA-C 107.073 -1.455 . . . . 0.0 107.073 178.11 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.535 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 90.3 m-20 -90.74 6.22 45.0 Favored 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.818 173.844 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.8 m -54.13 -29.95 47.06 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.583 1.153 . . . . 0.0 111.971 -177.751 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -64.94 -25.16 70.58 Favored Glycine 0 CA--C 1.523 0.589 0 C-N-CA 121.59 -0.338 . . . . 0.0 112.295 178.444 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 72.8 mt -92.22 -23.03 19.48 Favored 'General case' 0 CA--C 1.496 -1.097 0 CA-C-O 120.816 0.341 . . . . 0.0 110.198 179.099 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 67' ' ' ASN . 21.5 mt -78.94 152.18 31.24 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.788 -172.418 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 72.9 mttt . . . . . 0 N--CA 1.422 -1.875 0 CA-C-O 122.981 1.372 . . . . 0.0 114.589 177.013 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.512 -0.486 0 CA-C-O 121.813 0.816 . . . . 0.0 110.1 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 15.2 mm-40 -119.69 7.24 11.02 Favored 'General case' 0 C--N 1.28 -2.431 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 -178.258 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 50.0 m -132.7 134.27 44.57 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 114.197 -1.365 . . . . 0.0 111.917 -173.837 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.9 mt -78.64 157.74 28.59 Favored 'General case' 0 C--N 1.315 -0.93 0 O-C-N 123.499 0.499 . . . . 0.0 109.731 175.807 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -72.89 158.47 35.44 Favored 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 173.054 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -90.06 -3.92 57.67 Favored 'General case' 0 C--N 1.293 -1.862 0 CA-C-O 121.075 0.464 . . . . 0.0 111.249 -178.47 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -99.25 11.37 39.25 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -177.858 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 32.6 mt -84.24 166.82 17.2 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-O 121.854 0.835 . . . . 0.0 113.162 -170.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.627 HG21 HD12 ' A' ' 87' ' ' LEU . 53.8 mt -142.23 173.61 7.21 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 N-CA-C 105.14 -2.17 . . . . 0.0 105.14 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.643 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 25.8 t70 -67.95 -142.03 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.95 0 CA-C-O 117.37 -1.3 . . . . 0.0 110.438 -179.524 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.509 ' HA ' ' O ' ' A' ' 89' ' ' TYR . 9.5 pt-20 -40.53 -18.62 0.01 OUTLIER 'General case' 0 N--CA 1.509 2.503 0 N-CA-C 117.625 2.454 . . . . 0.0 117.625 -173.09 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.627 HD12 HG21 ' A' ' 84' ' ' ILE . 21.0 mt -62.24 -51.57 67.23 Favored 'General case' 0 C--N 1.285 -2.232 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 171.049 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -102.12 -45.82 5.03 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.903 -177.462 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' TYR . . . . . 0.665 ' CG ' HD11 ' A' ' 32' ' ' LEU . 0.9 OUTLIER -140.3 167.89 21.08 Favored 'General case' 0 C--O 1.164 -3.416 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.669 -174.096 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.495 ' O ' HD12 ' A' ' 32' ' ' LEU . 4.3 mt -136.16 146.69 28.77 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.511 0 O-C-N 120.851 -1.156 . . . . 0.0 110.665 178.886 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.461 HD23 ' HA ' ' A' ' 91' ' ' LEU . 64.5 mt -109.04 133.72 52.61 Favored 'General case' 0 C--N 1.291 -1.958 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.761 178.651 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.46 HD12 ' N ' ' A' ' 92' ' ' LEU . 1.0 OUTLIER -140.78 156.13 68.97 Favored Pre-proline 0 C--N 1.289 -2.038 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 -178.54 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.657 ' HD2' ' HB3' ' A' ' 19' ' ' LEU . 39.6 Cg_exo -64.58 168.9 12.19 Favored 'Trans proline' 0 C--O 1.252 1.215 0 C-N-CA 122.975 2.45 . . . . 0.0 111.225 175.789 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.469 HG22 ' ND2' ' A' ' 98' ' ' ASN . 86.9 m -45.62 -47.76 14.73 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 124.421 1.088 . . . . 0.0 109.766 172.982 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.538 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.1 mp0 -51.8 -54.41 29.07 Favored 'General case' 0 C--O 1.209 -1.027 0 C-N-CA 125.421 1.488 . . . . 0.0 110.689 178.386 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.561 ' O ' HD22 ' A' ' 100' ' ' LEU . . . -54.98 -60.97 7.89 Favored Glycine 0 N--CA 1.43 -1.748 0 O-C-N 124.388 1.055 . . . . 0.0 111.273 -177.533 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.46 ' HZ2' HD11 ' A' ' 106' ' ' LEU . 68.5 t-105 -52.13 -50.22 62.13 Favored 'General case' 0 C--N 1.308 -1.238 0 C-N-CA 124.361 1.064 . . . . 0.0 111.184 178.385 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.469 ' ND2' HG22 ' A' ' 94' ' ' THR . 89.6 m-20 -53.47 -37.21 62.45 Favored 'General case' 0 C--O 1.187 -2.208 0 CA-C-O 118.791 -0.623 . . . . 0.0 111.585 177.74 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.464 ' HG3' ' O ' ' A' ' 95' ' ' GLU . 87.6 mttt -69.56 -50.36 45.57 Favored 'General case' 0 N--CA 1.41 -2.449 0 CA-C-N 118.6 0.636 . . . . 0.0 109.827 -178.868 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.561 HD22 ' O ' ' A' ' 96' ' ' GLY . 0.8 OUTLIER -58.75 -38.49 78.55 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.295 0.569 . . . . 0.0 111.731 178.588 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.414 ' O ' ' HA ' ' A' ' 105' ' ' THR . 37.9 t -74.35 -31.16 27.8 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.931 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.428 178.816 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 57.9 m -72.17 -36.16 69.2 Favored 'General case' 0 N--CA 1.418 -2.071 0 CA-C-O 121.717 0.77 . . . . 0.0 109.512 -179.405 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' TRP . . . . . 0.407 ' CZ2' ' HB3' ' A' ' 99' ' ' LYS . 38.4 m0 -78.57 -51.33 10.08 Favored 'General case' 0 N--CA 1.424 -1.738 0 CA-C-N 114.692 -1.14 . . . . 0.0 111.998 -176.834 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -123.2 4.39 9.21 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 114.558 1.318 . . . . 0.0 114.558 -172.427 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.414 ' HA ' ' O ' ' A' ' 101' ' ' VAL 0.271 22.8 p 54.29 174.87 0.02 OUTLIER 'General case' 0 N--CA 1.413 -2.301 0 N-CA-C 116.089 1.885 . . . . 0.0 116.089 -177.856 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.674 ' CD1' ' HD3' ' A' ' 112' ' ' PRO . 0.5 OUTLIER -98.86 179.88 4.5 Favored 'General case' 0 N--CA 1.407 -2.621 0 CA-C-N 114.961 -1.018 . . . . 0.0 108.308 -179.974 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 107' ' ' MET . . . . . 0.619 ' H ' HD23 ' A' ' 106' ' ' LEU . 19.5 ttm -94.95 134.58 37.46 Favored 'General case' 1 N--CA 1.347 -5.621 0 CA-C-O 122.027 0.918 . . . . 0.0 109.846 178.08 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -64.32 123.63 19.65 Favored 'General case' 0 N--CA 1.393 -3.319 0 CA-C-N 113.316 -1.766 . . . . 0.0 111.267 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 112.33 -19.01 22.73 Favored Glycine 0 N--CA 1.405 -3.371 0 C-N-CA 119.911 -1.138 . . . . 0.0 111.626 178.463 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.492 ' HG2' ' O ' ' A' ' 107' ' ' MET . 2.6 pt20 -116.6 164.52 14.48 Favored 'General case' 0 N--CA 1.406 -2.628 0 C-N-CA 119.966 -0.694 . . . . 0.0 109.64 178.435 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -135.94 144.9 50.37 Favored Pre-proline 0 C--N 1.29 -1.985 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.15 -179.224 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' PRO . . . . . 0.674 ' HD3' ' CD1' ' A' ' 106' ' ' LEU . 36.3 Cg_exo -42.7 132.63 5.47 Favored 'Trans proline' 0 CA--C 1.457 -3.327 0 C-N-CA 125.216 3.944 . . . . 0.0 113.427 177.305 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.523 HD11 HD21 ' A' ' 71' ' ' LEU . 3.2 mp -93.11 106.53 18.05 Favored 'Isoleucine or valine' 1 N--CA 1.368 -4.541 0 CA-C-N 113.302 -1.772 . . . . 0.0 106.527 177.73 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 114' ' ' ALA . . . . . 0.428 ' HB1' ' CG2' ' A' ' 29' ' ' THR . . . -91.08 127.7 36.61 Favored 'General case' 0 N--CA 1.406 -2.649 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 177.53 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 15.2 tpt180 -121.63 129.79 53.05 Favored 'General case' 0 C--N 1.271 -2.817 0 N-CA-C 105.732 -1.951 . . . . 0.0 105.732 -177.745 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? -82.28 168.34 17.7 Favored 'General case' 0 C--N 1.272 -2.793 0 C-N-CA 119.687 -0.805 . . . . 0.0 109.014 176.476 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.645 HG21 ' O ' ' A' ' 25' ' ' ARG . 65.4 t . . . . . 0 C--N 1.316 -0.871 0 CA-C-O 122.03 0.919 . . . . 0.0 111.157 -178.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.5 mtt . . . . . 0 CA--C 1.499 -0.987 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -94.55 -179.88 5.04 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 123.628 0.58 . . . . 0.0 109.674 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 55.8 mm-40 60.05 103.11 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.024 1.73 . . . . 0.0 114.064 176.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -62.85 -43.67 98.58 Favored Glycine 0 CA--C 1.508 -0.373 0 N-CA-C 110.959 -0.856 . . . . 0.0 110.959 176.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -101.66 151.9 18.64 Favored Glycine 0 N--CA 1.427 -1.935 0 N-CA-C 107.868 -2.093 . . . . 0.0 107.868 173.464 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 70.8 -168.93 0.16 Allowed 'General case' 0 C--O 1.242 0.686 0 C-N-CA 123.572 0.749 . . . . 0.0 111.083 -177.345 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.526 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . -102.73 158.98 15.88 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.877 -178.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.671 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 10.9 t70 -70.2 151.53 45.27 Favored 'General case' 0 CA--C 1.482 -1.658 0 N-CA-C 107.403 -1.332 . . . . 0.0 107.403 173.322 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 19.0 mt -60.25 -38.06 82.32 Favored 'General case' 0 C--N 1.305 -1.334 0 CA-C-O 121.083 0.468 . . . . 0.0 110.887 -175.637 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -62.14 -31.45 71.93 Favored 'General case' 0 N--CA 1.488 1.473 0 CA-C-N 114.463 -1.244 . . . . 0.0 108.485 -178.327 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.585 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 3.9 m -80.01 -49.77 11.34 Favored 'General case' 1 N--CA 1.371 -4.395 0 CA-C-N 113.427 -1.715 . . . . 0.0 110.682 178.291 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.671 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 60.0 mt-30 -51.61 -61.54 2.19 Favored 'General case' 0 C--N 1.347 0.487 0 C-N-CA 123.096 0.558 . . . . 0.0 112.085 -174.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.494 ' HA ' ' CH2' ' A' ' 41' ' ' TRP . 6.8 ppt_? -57.74 -38.84 76.04 Favored 'General case' 0 C--O 1.208 -1.109 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -179.255 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.3 t -77.75 -36.8 50.35 Favored 'General case' 0 C--N 1.282 -2.337 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.549 -175.319 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.486 ' O ' ' HB ' ' A' ' 18' ' ' THR . 9.8 t70 -70.29 -41.39 73.42 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.464 0.65 . . . . 0.0 109.632 -177.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.567 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 44.7 mm -71.27 -31.89 45.4 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.906 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.306 178.28 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.99 -30.73 71.14 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.978 0.894 . . . . 0.0 108.695 177.508 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.499 ' HA ' ' HE2' ' A' ' 21' ' ' LYS . 1.0 OUTLIER -71.59 -25.96 62.4 Favored 'General case' 0 N--CA 1.4 -2.96 0 CA-C-N 114.198 -1.365 . . . . 0.0 110.488 178.179 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.519 ' HB3' ' CG ' ' A' ' 93' ' ' PRO . 76.6 mt -85.2 -17.54 36.8 Favored 'General case' 0 C--N 1.282 -2.349 0 CA-C-O 121.038 0.447 . . . . 0.0 111.311 -177.268 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.567 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 12.3 mt -86.11 -26.71 25.1 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 -179.328 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.499 ' HE2' ' HA ' ' A' ' 18' ' ' THR . 0.0 OUTLIER -91.72 -5.34 53.83 Favored 'General case' 0 N--CA 1.432 -1.333 0 CA-C-N 114.458 -1.246 . . . . 0.0 110.344 177.692 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.447 ' HB ' ' HA ' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -76.43 138.82 40.58 Favored 'General case' 0 N--CA 1.415 -2.182 0 CA-C-N 113.2 -1.818 . . . . 0.0 110.868 178.727 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 71.2 m -57.56 142.96 42.77 Favored 'General case' 0 C--N 1.283 -2.318 0 CA-C-N 113.086 -1.87 . . . . 0.0 111.699 179.401 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.651 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP 0.296 0.5 OUTLIER -91.33 -27.07 18.62 Favored 'General case' 0 CA--C 1.465 -2.324 0 N-CA-C 116.743 2.127 . . . . 0.0 116.743 -175.315 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.511 ' O ' HG21 ' A' ' 117' ' ' VAL . 0.0 OUTLIER 63.67 112.01 0.03 OUTLIER 'General case' 0 C--N 1.249 -3.789 0 C-N-CA 127.782 2.433 . . . . 0.0 111.899 179.144 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -60.95 113.04 2.31 Favored 'General case' 0 C--N 1.292 -1.92 0 CA-C-O 121.233 0.539 . . . . 0.0 111.972 -177.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 103.16 7.57 43.3 Favored Glycine 0 N--CA 1.437 -1.29 0 CA-C-N 115.074 -0.966 . . . . 0.0 112.3 -177.195 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.478 ' HB2' ' HB2' ' A' ' 25' ' ' ARG . 4.8 t70 -87.39 -177.7 6.0 Favored 'General case' 0 C--O 1.248 1.013 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.473 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 40.3 m -126.74 118.06 23.95 Favored 'General case' 0 N--CA 1.424 -1.773 0 CA-C-O 121.427 0.632 . . . . 0.0 110.285 -176.601 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.651 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 18.2 m95 -107.01 164.72 11.9 Favored 'General case' 0 C--N 1.288 -2.084 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 178.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.415 ' O ' ' HA ' ' A' ' 91' ' ' LEU . 86.7 m-85 -122.43 137.51 54.84 Favored 'General case' 0 C--N 1.278 -2.501 0 N-CA-C 110.329 -0.249 . . . . 0.0 110.329 -178.851 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.46 ' CD1' ' HB2' ' A' ' 115' ' ' ARG . 9.5 mp -78.74 152.3 31.6 Favored 'General case' 0 C--N 1.309 -1.171 0 C-N-CA 120.275 -0.57 . . . . 0.0 111.626 178.586 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.5 HG12 ' O ' ' A' ' 34' ' ' ASP . 7.2 t -137.75 142.06 37.33 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.624 0 N-CA-C 105.691 -1.966 . . . . 0.0 105.691 172.208 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.5 ' O ' HG12 ' A' ' 33' ' ' VAL . 3.7 p-10 -71.05 141.12 50.9 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 173.878 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 33.5 p -69.48 -22.21 63.64 Favored 'General case' 0 C--N 1.285 -2.202 0 C-N-CA 120.404 -0.518 . . . . 0.0 111.814 -173.752 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 90.9 mtt180 -73.37 -40.58 64.25 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.005 -173.605 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.437 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 71.7 t90 -63.66 -48.05 78.79 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 108.28 -1.008 . . . . 0.0 108.28 178.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.535 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 32.6 t80 -63.29 -43.61 97.38 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-N 114.793 -1.094 . . . . 0.0 110.802 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.471 ' HA ' ' HE2' ' A' ' 42' ' ' LYS . 94.7 mttt -63.02 -34.12 76.88 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 176.698 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.437 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 17.7 tp60 -65.35 -43.87 89.51 Favored 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 172.776 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.494 ' CH2' ' HA ' ' A' ' 13' ' ' ARG . 65.6 t90 -58.94 -41.97 88.67 Favored 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 114.778 -1.101 . . . . 0.0 110.872 177.609 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.535 ' HG3' ' O ' ' A' ' 38' ' ' PHE . 40.4 mtmt -54.02 -41.89 68.51 Favored 'General case' 0 CA--C 1.507 -0.708 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 179.652 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -63.41 -49.31 74.28 Favored 'General case' 0 CA--C 1.504 -0.819 0 O-C-N 124.111 0.882 . . . . 0.0 109.89 178.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.592 ' HB2' HG23 ' A' ' 60' ' ' VAL . 0.1 OUTLIER -66.08 -41.4 90.73 Favored 'General case' 0 N--CA 1.427 -1.619 0 CA-C-N 114.257 -1.338 . . . . 0.0 112.003 -173.792 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.434 HG12 ' O ' ' A' ' 41' ' ' TRP . 5.7 p -90.36 -21.23 6.71 Favored 'Isoleucine or valine' 0 N--CA 1.395 -3.178 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.513 -174.269 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.638 ' HA2' ' HG3' ' A' ' 52' ' ' LYS . . . 84.78 33.05 19.9 Favored Glycine 0 N--CA 1.418 -2.51 0 C-N-CA 120.32 -0.943 . . . . 0.0 111.162 -175.719 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.419 ' HB3' ' HA ' ' A' ' 42' ' ' LYS . 49.9 t80 -74.67 -41.3 60.54 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -88.25 121.36 30.56 Favored 'General case' 0 C--N 1.311 -1.077 0 N-CA-C 107.144 -1.428 . . . . 0.0 107.144 -178.02 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 31.6 m -60.13 -15.82 26.99 Favored 'General case' 0 C--N 1.297 -1.709 0 N-CA-C 117.323 2.342 . . . . 0.0 117.323 -168.548 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 63.6 p-90 -104.07 -9.47 18.75 Favored 'General case' 0 N--CA 1.379 -3.986 0 CA-C-N 120.484 1.493 . . . . 0.0 107.67 -177.751 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -122.13 73.5 1.1 Allowed 'General case' 0 N--CA 1.423 -1.78 0 CA-C-N 114.954 -1.021 . . . . 0.0 109.844 -165.069 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.638 ' HG3' ' HA2' ' A' ' 46' ' ' GLY . 0.0 OUTLIER -121.5 28.29 7.8 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.179 177.829 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -81.81 -26.34 34.43 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 175.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.611 ' HB3' HG11 ' A' ' 60' ' ' VAL . 11.2 mm100 -97.83 0.94 47.67 Favored 'General case' 0 N--CA 1.413 -2.298 0 CA-C-N 114.35 -1.295 . . . . 0.0 109.995 -178.151 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' MET . . . . . 0.424 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 14.3 tmm? -64.95 116.97 6.93 Favored 'General case' 0 N--CA 1.414 -2.252 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.608 -177.607 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 83.36 3.85 89.77 Favored Glycine 0 N--CA 1.431 -1.692 0 CA-C-N 114.468 -1.242 . . . . 0.0 111.692 -179.193 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.598 ' HB3' HG22 ' A' ' 60' ' ' VAL . 5.5 t0 -82.07 147.1 29.3 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 -176.408 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -84.33 -22.3 30.65 Favored 'General case' 0 C--N 1.296 -1.751 0 CA-C-O 121.347 0.594 . . . . 0.0 110.64 -178.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -60.8 -31.77 71.14 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 121.925 0.869 . . . . 0.0 110.783 -179.147 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.611 HG11 ' HB3' ' A' ' 54' ' ' GLN . 27.9 m -105.99 8.49 9.66 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.123 0 CA-C-N 114.457 -1.247 . . . . 0.0 111.881 -172.729 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -60.12 119.04 38.51 Favored Pre-proline 0 C--N 1.304 -1.41 0 O-C-N 124.258 0.974 . . . . 0.0 109.349 179.326 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_endo -88.07 112.9 0.77 Allowed 'Trans proline' 0 N--CA 1.415 -3.113 0 C-N-CA 122.385 2.057 . . . . 0.0 108.905 174.142 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -68.7 -139.47 0.08 OUTLIER Glycine 0 C--N 1.288 -2.138 0 CA-C-N 114.926 -1.034 . . . . 0.0 112.56 176.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.46 ' HA ' ' O ' ' A' ' 104' ' ' TYR . 28.7 Cg_exo -64.32 137.42 55.85 Favored 'Trans proline' 0 C--O 1.248 0.988 0 C-N-CA 122.075 1.85 . . . . 0.0 112.048 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 65.2 mt -60.01 124.15 13.82 Favored 'Isoleucine or valine' 0 C--O 1.242 0.685 0 C-N-CA 123.389 0.676 . . . . 0.0 110.345 -178.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -116.58 104.56 11.53 Favored 'General case' 0 CA--C 1.501 -0.934 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -172.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.617 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 45.6 m-80 -95.0 12.43 28.47 Favored 'General case' 0 C--N 1.295 -1.778 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.567 -176.561 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 49.6 m -56.55 -34.7 67.35 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -177.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -72.26 -16.15 77.04 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 121.506 -0.378 . . . . 0.0 112.404 178.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 48.0 mt -93.28 -31.52 14.67 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 178.705 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.617 ' HG ' ' O ' ' A' ' 67' ' ' ASN . 70.0 mt -76.45 146.02 38.87 Favored 'General case' 0 N--CA 1.433 -1.286 0 CA-C-N 114.65 -1.159 . . . . 0.0 110.646 -176.769 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 62.8 mttt -70.54 171.77 9.66 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 -177.821 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -75.35 101.28 4.69 Favored 'General case' 0 C--N 1.297 -1.676 0 CA-C-N 113.442 -1.708 . . . . 0.0 109.115 -179.011 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 114.04 -36.42 4.01 Favored Glycine 0 N--CA 1.432 -1.633 0 C-N-CA 120.218 -0.992 . . . . 0.0 113.243 177.208 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -118.74 131.0 56.12 Favored 'General case' 0 CA--C 1.49 -1.333 0 CA-C-N 117.16 0.48 . . . . 0.0 110.655 -177.187 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.444 ' HA ' HD13 ' A' ' 71' ' ' LEU . . . -88.95 3.29 51.99 Favored 'General case' 0 C--N 1.3 -1.552 0 CA-C-O 121.925 0.869 . . . . 0.0 110.028 179.264 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 38.8 mm-40 -117.04 5.58 12.83 Favored 'General case' 0 C--N 1.285 -2.203 0 CA-C-O 122.147 0.975 . . . . 0.0 108.791 -174.5 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 35.8 m -122.65 125.07 44.88 Favored 'General case' 0 C--N 1.281 -2.381 0 CA-C-N 114.007 -1.451 . . . . 0.0 109.75 -176.538 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.432 HD22 ' N ' ' A' ' 79' ' ' LEU . 2.4 mm? -85.02 151.1 24.42 Favored 'General case' 0 N--CA 1.428 -1.531 0 C-N-CA 123.361 0.664 . . . . 0.0 110.241 178.0 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.537 ' HB2' ' CD1' ' A' ' 83' ' ' LEU . 99.2 mttt -76.92 168.13 20.62 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-O 121.285 0.564 . . . . 0.0 111.377 176.88 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -74.25 -45.91 44.86 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 114.678 1.362 . . . . 0.0 114.678 -172.613 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 26.4 m-70 -81.3 -0.16 39.71 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -167.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.55 ' HB3' ' CE2' ' A' ' 89' ' ' TYR . 8.9 mp -57.3 133.02 54.76 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -179.56 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.676 HG21 HD12 ' A' ' 87' ' ' LEU . 49.5 mt -129.82 174.53 12.46 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.379 0 N-CA-C 104.926 -2.25 . . . . 0.0 104.926 177.829 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.463 ' N ' HG22 ' A' ' 84' ' ' ILE . 62.4 t0 -57.12 -151.82 0.0 OUTLIER 'General case' 0 CA--C 1.594 2.657 0 C-N-CA 126.58 1.952 . . . . 0.0 110.412 179.167 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.722 ' HA ' ' O ' ' A' ' 89' ' ' TYR 0.322 0.0 OUTLIER -39.24 -17.81 0.01 OUTLIER 'General case' 1 N--CA 1.545 4.321 0 N-CA-C 117.884 2.55 . . . . 0.0 117.884 -172.558 . . . . . . . . 5 4 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.676 HD12 HG21 ' A' ' 84' ' ' ILE . 31.5 mt -60.8 -46.26 91.18 Favored 'General case' 0 C--N 1.278 -2.531 0 C-N-CA 124.683 1.193 . . . . 0.0 110.112 171.143 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -114.69 -45.8 2.98 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-O 121.407 0.623 . . . . 0.0 109.452 -178.468 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' TYR . . . . . 0.722 ' O ' ' HA ' ' A' ' 86' ' ' GLU . 2.0 p90 -138.27 -169.45 2.59 Favored 'General case' 1 C--O 1.139 -4.72 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 -176.114 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.423 HD13 HG21 ' A' ' 90' ' ' ILE . 8.6 mt -149.05 162.85 4.68 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.903 0 N-CA-C 106.03 -1.841 . . . . 0.0 106.03 173.357 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.451 HD13 ' HA ' ' A' ' 32' ' ' LEU . 2.5 mm? -120.12 147.41 44.91 Favored 'General case' 0 N--CA 1.404 -2.77 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 172.841 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -124.38 153.53 69.05 Favored Pre-proline 0 C--N 1.271 -2.811 0 CA-C-N 114.616 -1.175 . . . . 0.0 108.689 171.685 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.519 ' CG ' ' HB3' ' A' ' 19' ' ' LEU . 5.3 Cg_endo -63.24 168.18 11.44 Favored 'Trans proline' 0 N--CA 1.432 -2.107 0 N-CA-C 107.668 -1.705 . . . . 0.0 107.668 167.063 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 14.7 m -44.36 -48.14 9.72 Favored 'General case' 0 C--N 1.298 -1.652 0 O-C-N 123.743 0.652 . . . . 0.0 110.93 175.11 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -67.13 -38.92 86.41 Favored 'General case' 0 CA--C 1.472 -2.054 0 CA-C-N 115.052 -0.976 . . . . 0.0 112.086 -177.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.521 ' O ' ' HG ' ' A' ' 100' ' ' LEU . . . -63.86 -51.08 56.54 Favored Glycine 0 N--CA 1.405 -3.37 0 C-N-CA 120.575 -0.821 . . . . 0.0 111.129 -176.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 63.5 t-105 -59.7 -48.98 79.51 Favored 'General case' 0 C--N 1.292 -1.913 0 CA-C-N 114.198 -1.001 . . . . 0.0 110.273 175.606 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 -51.52 -38.49 54.36 Favored 'General case' 0 C--O 1.195 -1.79 0 O-C-N 123.389 0.43 . . . . 0.0 111.641 176.132 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 28.3 mttm -66.03 -50.4 64.33 Favored 'General case' 0 CA--C 1.47 -2.109 0 CA-C-O 121.239 0.542 . . . . 0.0 110.308 -179.549 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' A' ' 96' ' ' GLY . 67.1 mt -67.61 -31.84 72.14 Favored 'General case' 0 C--N 1.275 -2.66 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.765 -176.116 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.548 ' HA ' ' HA ' ' A' ' 105' ' ' THR . 25.0 t -80.28 -24.83 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.398 -3.032 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.017 175.739 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 20.4 t -78.24 -35.05 48.8 Favored 'General case' 0 C--N 1.299 -1.626 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 178.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' TRP . . . . . 0.459 ' CE3' HD23 ' A' ' 100' ' ' LEU . 34.7 m0 -82.99 -48.87 10.18 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.311 -177.395 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' TYR . . . . . 0.46 ' O ' ' HA ' ' A' ' 64' ' ' PRO . 60.9 m-85 -130.54 6.74 4.82 Favored 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 -173.159 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.548 ' HA ' ' HA ' ' A' ' 101' ' ' VAL 0.27 11.1 t 48.24 -173.27 0.01 OUTLIER 'General case' 0 C--O 1.236 0.389 0 CA-C-O 123.895 1.807 . . . . 0.0 115.13 -179.71 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -105.15 151.81 23.59 Favored 'General case' 1 C--N 1.236 -4.353 0 CA-C-N 112.213 -2.267 . . . . 0.0 105.724 -174.232 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 54.4 mmm -64.14 155.96 29.95 Favored 'General case' 0 CA--C 1.495 -1.146 0 CA-C-O 121.855 0.836 . . . . 0.0 111.627 175.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 20.1 pm0 -75.15 137.88 41.65 Favored 'General case' 0 N--CA 1.389 -3.5 0 CA-C-N 114.346 -1.297 . . . . 0.0 109.289 178.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 89.72 4.12 73.27 Favored Glycine 0 N--CA 1.422 -2.244 0 CA-C-N 114.999 -1.001 . . . . 0.0 112.267 179.353 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -120.48 169.17 10.58 Favored 'General case' 0 CA--C 1.482 -1.636 0 CA-C-O 121.689 0.756 . . . . 0.0 111.634 -178.45 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -137.76 158.87 70.83 Favored Pre-proline 0 N--CA 1.412 -2.325 0 CA-C-N 114.013 -1.449 . . . . 0.0 107.091 178.217 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_exo -67.14 134.49 34.15 Favored 'Trans proline' 0 CA--C 1.459 -3.253 0 C-N-CA 122.705 2.27 . . . . 0.0 111.255 175.445 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 3.7 mp -94.76 107.03 18.87 Favored 'Isoleucine or valine' 1 N--CA 1.377 -4.121 0 CA-C-N 113.654 -1.612 . . . . 0.0 106.97 176.646 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.473 ' HB1' ' CG2' ' A' ' 29' ' ' THR . . . -94.02 128.4 40.36 Favored 'General case' 0 N--CA 1.41 -2.452 0 CA-C-O 121.94 0.876 . . . . 0.0 111.124 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.46 ' HB2' ' CD1' ' A' ' 32' ' ' LEU . 17.0 tpt180 -119.69 120.5 36.8 Favored 'General case' 0 C--N 1.28 -2.43 0 CA-C-N 113.909 -1.496 . . . . 0.0 108.085 -175.682 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -67.81 155.94 38.19 Favored 'General case' 0 N--CA 1.424 -1.741 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 172.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.511 HG21 ' O ' ' A' ' 25' ' ' ARG . 90.8 t -60.54 146.21 11.34 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.699 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 175.235 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' VAL . . . . . 0.471 ' HB ' ' HG2' ' A' ' 120' ' ' GLN . 5.2 m -67.13 150.28 11.17 Favored 'Isoleucine or valine' 0 N--CA 1.392 -3.333 0 CA-C-N 114.382 -1.281 . . . . 0.0 112.517 -175.377 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -95.3 -8.27 36.4 Favored 'General case' 0 C--N 1.285 -2.227 0 CA-C-N 113.838 -1.528 . . . . 0.0 110.392 -171.384 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.471 ' HG2' ' HB ' ' A' ' 118' ' ' VAL . 17.5 pt20 . . . . . 0 C--N 1.305 -1.33 0 CA-C-N 114.107 -1.406 . . . . 0.0 111.536 177.331 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 mpt? . . . . . 0 CA--C 1.5 -0.95 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -82.48 96.76 8.11 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 178.563 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -89.95 109.17 20.21 Favored 'General case' 0 C--N 1.296 -1.76 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.857 -177.299 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -155.41 10.49 0.36 Allowed Glycine 0 C--N 1.298 -1.57 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.416 177.305 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -84.76 86.16 1.56 Allowed Glycine 0 N--CA 1.441 -0.995 0 N-CA-C 111.394 -0.682 . . . . 0.0 111.394 -176.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.629 ' HA ' ' CD1' ' A' ' 103' ' ' TRP . . . -89.0 136.24 33.12 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-O 121.063 0.458 . . . . 0.0 112.15 -176.53 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.22 172.11 1.17 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.285 -1.325 . . . . 0.0 112.484 179.387 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.666 ' O ' ' HB ' ' A' ' 11' ' ' THR . 0.6 OUTLIER -62.43 140.07 58.57 Favored 'General case' 0 C--O 1.207 -1.138 0 CA-C-N 114.842 -1.072 . . . . 0.0 108.811 170.298 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.507 ' O ' ' HG3' ' A' ' 13' ' ' ARG . 16.9 mt -61.08 -42.32 98.28 Favored 'General case' 0 CA--C 1.489 -1.4 0 CA-C-O 121.68 0.752 . . . . 0.0 110.77 -174.354 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -64.99 -23.67 67.29 Favored 'General case' 0 C--N 1.292 -1.91 0 CA-C-N 114.424 -1.262 . . . . 0.0 109.464 -177.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.666 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 2.6 m -78.42 -51.65 9.73 Favored 'General case' 0 N--CA 1.389 -3.497 0 CA-C-N 114.722 -1.126 . . . . 0.0 109.761 174.153 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.643 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 52.0 mt-30 -51.58 -53.77 34.57 Favored 'General case' 0 C--N 1.353 0.733 0 C-N-CA 123.528 0.731 . . . . 0.0 111.492 -175.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.547 ' HG2' HG13 ' A' ' 45' ' ' VAL . 45.1 mtm180 -45.06 -58.21 3.35 Favored 'General case' 0 N--CA 1.486 1.374 0 CA-C-O 121.942 0.877 . . . . 0.0 110.598 177.865 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 74.3 m -66.68 -45.96 77.19 Favored 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 113.735 -1.575 . . . . 0.0 112.769 -172.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.5 t0 -66.28 -39.57 89.49 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.977 -176.483 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.594 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 26.2 mm -76.07 -37.88 34.03 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.353 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.268 178.36 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.548 ' O ' ' HG2' ' A' ' 21' ' ' LYS . . . -57.79 -39.87 78.53 Favored 'General case' 0 CA--C 1.495 -1.156 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.435 ' HA ' ' HD3' ' A' ' 21' ' ' LYS . 5.7 m -60.22 -36.28 77.34 Favored 'General case' 0 N--CA 1.396 -3.143 0 CA-C-N 113.372 -1.74 . . . . 0.0 112.015 179.401 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.464 ' HB3' ' CG ' ' A' ' 93' ' ' PRO . 71.8 mt -85.65 -13.33 48.92 Favored 'General case' 0 C--N 1.269 -2.918 0 O-C-N 121.611 -0.68 . . . . 0.0 112.495 -176.755 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.594 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 16.2 mt -86.04 -25.25 26.02 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 177.101 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.548 ' HG2' ' O ' ' A' ' 17' ' ' ALA . 19.6 ptmt -91.42 -22.11 20.62 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.596 -176.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 16.4 m -51.06 134.95 25.98 Favored 'General case' 0 N--CA 1.402 -2.839 0 C-N-CA 125.204 1.402 . . . . 0.0 111.639 174.78 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 72.8 m -77.47 149.59 35.02 Favored 'General case' 0 N--CA 1.395 -3.2 0 CA-C-N 113.529 -1.669 . . . . 0.0 111.649 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -111.44 168.01 9.87 Favored 'General case' 0 N--CA 1.41 -2.44 0 CA-C-N 115.275 -0.875 . . . . 0.0 112.158 178.62 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.406 ' O ' HG21 ' A' ' 117' ' ' VAL . 0.0 OUTLIER -143.32 152.26 41.44 Favored 'General case' 0 C--N 1.281 -2.393 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 175.743 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -55.08 128.55 34.23 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 121.094 0.474 . . . . 0.0 110.858 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 113.3 -18.3 20.96 Favored Glycine 0 N--CA 1.424 -2.142 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.533 -177.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -72.28 141.15 48.9 Favored 'General case' 0 CA--C 1.498 -1.023 0 CA-C-N 117.288 0.544 . . . . 0.0 110.637 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 49.0 m -97.59 134.34 40.93 Favored 'General case' 0 C--N 1.294 -1.806 0 N-CA-C 107.448 -1.315 . . . . 0.0 107.448 175.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.425 ' HB3' ' HB3' ' A' ' 91' ' ' LEU . 39.3 m95 -120.12 137.04 54.38 Favored 'General case' 0 C--N 1.282 -2.364 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 179.662 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 67.6 m-85 -98.24 121.66 40.44 Favored 'General case' 0 C--N 1.264 -3.132 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.041 -176.071 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.782 HD11 ' CD1' ' A' ' 89' ' ' TYR . 15.9 tp -81.07 138.96 35.96 Favored 'General case' 0 N--CA 1.4 -2.933 0 CA-C-N 115.114 -0.948 . . . . 0.0 113.348 -178.588 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.494 HG12 ' O ' ' A' ' 34' ' ' ASP . 58.4 t -132.8 150.67 33.28 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.128 0 C-N-CA 126.126 1.77 . . . . 0.0 107.285 -177.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.684 ' HB2' HD21 ' A' ' 70' ' ' LEU . 6.8 t70 -72.16 136.86 46.61 Favored 'General case' 0 C--N 1.284 -2.264 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 169.553 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.418 ' OG ' ' HE3' ' A' ' 39' ' ' LYS . 29.1 t -68.8 -31.58 70.68 Favored 'General case' 0 C--N 1.3 -1.586 0 CA-C-O 121.028 0.442 . . . . 0.0 111.177 -174.804 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.431 ' HB2' ' OD2' ' A' ' 34' ' ' ASP . 55.7 mtt180 -69.66 -34.16 73.61 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.373 -175.073 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.494 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 76.5 t90 -67.5 -45.48 75.69 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 177.405 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.447 ' CG ' HD12 ' A' ' 90' ' ' ILE . 23.7 t80 -65.18 -39.69 93.24 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.112 -179.203 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.43 ' HA ' ' HD3' ' A' ' 42' ' ' LYS . 98.4 mttt -64.64 -33.68 76.52 Favored 'General case' 0 CA--C 1.506 -0.723 0 CA-C-O 120.898 0.38 . . . . 0.0 111.511 175.611 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.494 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 5.9 tp-100 -64.42 -44.54 90.92 Favored 'General case' 0 N--CA 1.408 -2.571 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 175.6 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 65.1 t90 -60.76 -43.4 98.04 Favored 'General case' 0 C--O 1.217 -0.633 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.396 176.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.594 ' HG2' ' CD1' ' A' ' 47' ' ' PHE . 15.3 mtpp -57.35 -39.29 75.62 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 123.153 0.581 . . . . 0.0 112.109 -178.204 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 40.3 mttp -72.97 -40.29 65.43 Favored 'General case' 0 C--N 1.285 -2.211 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 177.627 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.606 ' HB2' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -68.76 -38.15 79.88 Favored 'General case' 0 C--N 1.289 -2.049 0 CA-C-N 114.861 -1.063 . . . . 0.0 110.142 -176.956 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.547 HG13 ' HG2' ' A' ' 13' ' ' ARG . 4.3 p -88.79 -17.84 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.626 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.499 -176.258 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.42 ' HA2' ' CB ' ' A' ' 52' ' ' LYS . . . 83.07 27.96 38.95 Favored Glycine 0 N--CA 1.438 -1.227 0 C-N-CA 120.418 -0.896 . . . . 0.0 112.138 -174.907 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.594 ' CD1' ' HG2' ' A' ' 42' ' ' LYS . 48.8 t80 -72.73 -38.3 67.46 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 176.171 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.461 ' HB2' ' O ' ' A' ' 51' ' ' ASP . 71.4 m-20 -73.82 111.2 8.74 Favored 'General case' 0 CA--C 1.491 -1.289 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 174.213 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 11.0 m -60.95 -37.23 81.66 Favored 'General case' 0 C--N 1.297 -1.677 0 CA-C-O 121.573 0.701 . . . . 0.0 109.694 178.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 49.2 p90 -81.74 -15.55 53.97 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 114.912 -1.04 . . . . 0.0 111.336 -179.112 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.461 ' O ' ' HB2' ' A' ' 48' ' ' ASP . 7.6 t70 -141.13 86.87 2.06 Favored 'General case' 0 CA--C 1.475 -1.932 0 CA-C-O 122.364 1.078 . . . . 0.0 110.82 -175.859 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.42 ' CB ' ' HA2' ' A' ' 46' ' ' GLY . 63.7 pttt -142.33 18.77 2.07 Favored 'General case' 0 C--N 1.28 -2.427 0 CA-C-N 113.95 -1.477 . . . . 0.0 110.225 -179.295 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -60.55 -28.43 68.43 Favored 'General case' 0 C--N 1.292 -1.894 0 CA-C-N 112.747 -2.024 . . . . 0.0 107.355 172.146 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -94.8 11.92 29.82 Favored 'General case' 0 N--CA 1.421 -1.898 0 CA-C-N 113.958 -1.474 . . . . 0.0 111.661 -174.456 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' MET . . . . . 0.498 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 43.8 ttm -59.46 113.04 1.99 Allowed 'General case' 0 N--CA 1.429 -1.503 0 CA-C-O 121.013 0.435 . . . . 0.0 111.059 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.38 4.78 90.04 Favored Glycine 0 N--CA 1.437 -1.296 0 CA-C-N 115.393 -0.821 . . . . 0.0 112.569 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.574 ' HB3' HG22 ' A' ' 60' ' ' VAL . 4.8 t70 -76.46 148.99 36.86 Favored 'General case' 0 CA--C 1.509 -0.596 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 -176.735 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -83.7 -14.59 51.34 Favored 'General case' 0 C--N 1.299 -1.592 0 CA-C-O 122.117 0.96 . . . . 0.0 109.618 -178.295 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 33.2 m-80 -65.34 -25.98 67.83 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.551 175.141 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.606 HG23 ' HB2' ' A' ' 44' ' ' TYR . 34.1 m -119.9 3.19 6.87 Favored 'Isoleucine or valine' 0 CA--C 1.476 -1.871 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -172.354 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.457 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 5.3 p90 -62.43 118.11 37.36 Favored Pre-proline 0 C--N 1.308 -1.228 0 C-N-CA 119.334 -0.946 . . . . 0.0 109.291 178.691 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 61' ' ' TYR . 10.1 Cg_endo -88.63 111.04 0.6 Allowed 'Trans proline' 0 N--CA 1.418 -2.936 0 C-N-CA 122.397 2.065 . . . . 0.0 110.088 177.48 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -69.66 -153.9 0.88 Allowed Glycine 0 C--N 1.285 -2.286 0 CA-C-N 115.081 -0.963 . . . . 0.0 112.066 175.249 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.511 ' HB2' ' SD ' ' A' ' 107' ' ' MET . 88.6 Cg_exo -51.38 137.61 47.48 Favored 'Trans proline' 0 C--O 1.252 1.183 0 C-N-CA 122.929 2.419 . . . . 0.0 113.031 -179.721 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.424 HG12 ' CZ2' ' A' ' 37' ' ' TRP . 45.9 mt -64.18 110.51 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.012 0 CA-C-N 114.498 -1.228 . . . . 0.0 111.196 -175.718 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.532 ' HB2' ' HG3' ' A' ' 107' ' ' MET . 17.5 t70 -104.4 115.64 30.73 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.182 177.371 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -111.53 24.07 13.21 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.778 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 30.2 m -70.59 9.03 0.7 Allowed 'General case' 0 CA--C 1.554 1.133 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 -177.674 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -109.89 -4.97 29.47 Favored Glycine 0 CA--C 1.496 -1.105 0 C-N-CA 119.14 -1.505 . . . . 0.0 109.782 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.684 HD21 ' HB2' ' A' ' 34' ' ' ASP . 2.2 mm? -98.46 -52.99 3.46 Favored 'General case' 0 N--CA 1.418 -2.026 0 CA-C-N 113.482 -1.359 . . . . 0.0 109.797 -176.679 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.57 ' HA ' ' HA ' ' A' ' 79' ' ' LEU . 78.7 mt -59.86 147.13 39.5 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.224 -1.353 . . . . 0.0 113.842 -175.521 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.9 mtpt -83.52 -170.75 3.21 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-N 113.98 -1.463 . . . . 0.0 108.968 176.319 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -88.41 132.29 34.51 Favored 'General case' 0 C--N 1.286 -2.168 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.969 -172.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 82.27 -55.46 4.95 Favored Glycine 0 C--N 1.316 -0.567 0 N-CA-C 115.206 0.842 . . . . 0.0 115.206 173.145 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -57.46 -49.67 75.52 Favored 'General case' 0 CA--C 1.474 -1.977 0 CA-C-O 122.199 0.999 . . . . 0.0 112.889 -174.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . 58.22 13.59 2.4 Favored 'General case' 0 C--N 1.257 -3.431 0 CA-C-N 112.303 -2.226 . . . . 0.0 113.117 -176.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 -125.03 5.46 7.94 Favored 'General case' 0 CA--C 1.478 -1.8 0 N-CA-C 106.601 -1.629 . . . . 0.0 106.601 177.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.7 m -131.54 122.16 25.66 Favored 'General case' 0 C--N 1.28 -2.446 0 CA-C-N 112.594 -2.094 . . . . 0.0 109.061 -172.413 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.577 ' HG ' ' CD2' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -103.64 163.31 12.4 Favored 'General case' 0 N--CA 1.423 -1.814 0 O-C-N 123.451 0.469 . . . . 0.0 109.931 176.023 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.484 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 49.2 mtmt -60.59 116.5 4.4 Favored 'General case' 0 C--N 1.293 -1.85 0 CA-C-O 122.116 0.96 . . . . 0.0 111.802 -177.226 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.413 ' H ' ' CD ' ' A' ' 81' ' ' GLU . 1.2 pm0 -64.39 -8.99 15.22 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 115.027 1.492 . . . . 0.0 115.027 -172.776 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 46.0 m-70 -98.22 0.29 45.51 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 122.135 -0.353 . . . . 0.0 111.491 178.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.484 ' HG ' ' O ' ' A' ' 80' ' ' LYS . 56.6 mt -77.09 133.28 39.08 Favored 'General case' 0 C--O 1.248 1.026 0 CA-C-O 121.178 0.513 . . . . 0.0 109.808 179.719 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.62 HG21 HD12 ' A' ' 87' ' ' LEU . 49.2 mt -89.0 171.3 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.615 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 178.573 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.645 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 19.3 t70 -59.64 -139.52 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.971 0 C-N-CA 125.953 1.701 . . . . 0.0 111.041 -179.312 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.607 ' HA ' ' O ' ' A' ' 89' ' ' TYR . 0.1 OUTLIER -41.44 -18.82 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.565 0 N-CA-C 117.231 2.308 . . . . 0.0 117.231 -174.204 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.62 HD12 HG21 ' A' ' 84' ' ' ILE . 35.8 mt -60.96 -50.78 72.02 Favored 'General case' 0 C--N 1.292 -1.934 0 CA-C-O 121.57 0.7 . . . . 0.0 109.702 171.588 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -105.51 -45.79 4.35 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.794 -179.044 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' TYR . . . . . 0.782 ' CD1' HD11 ' A' ' 32' ' ' LEU . 1.5 p90 -139.09 -176.79 4.63 Favored 'General case' 0 C--O 1.161 -3.564 0 CA-C-O 119.323 -0.37 . . . . 0.0 110.703 -175.544 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.447 HD12 ' CG ' ' A' ' 38' ' ' PHE . 5.4 mt -143.48 151.53 16.8 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.472 0 CA-C-N 119.493 1.042 . . . . 0.0 109.329 176.334 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.498 HD23 ' HA ' ' A' ' 32' ' ' LEU . 64.2 mt -112.67 133.82 54.5 Favored 'General case' 0 N--CA 1.4 -2.961 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.268 175.822 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.464 HD11 HG21 ' A' ' 33' ' ' VAL . 56.0 mt -121.09 150.77 54.24 Favored Pre-proline 0 C--N 1.281 -2.404 0 CA-C-N 113.744 -1.571 . . . . 0.0 107.366 -178.419 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.464 ' CG ' ' HB3' ' A' ' 19' ' ' LEU . 72.2 Cg_endo -76.21 169.12 22.66 Favored 'Trans proline' 0 N--CA 1.429 -2.27 0 N-CA-C 107.902 -1.615 . . . . 0.0 107.902 172.508 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 58.1 m -38.25 -54.71 1.39 Allowed 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 123.999 0.92 . . . . 0.0 112.988 177.34 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -71.56 -32.44 68.11 Favored 'General case' 0 CA--C 1.498 -1.025 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -175.647 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.442 ' O ' ' HG ' ' A' ' 100' ' ' LEU . . . -59.03 -47.69 89.57 Favored Glycine 0 N--CA 1.436 -1.353 0 N-CA-C 109.99 -1.244 . . . . 0.0 109.99 177.858 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 69.1 t-105 -67.8 -50.05 58.98 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 123.512 0.725 . . . . 0.0 110.114 178.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -53.3 -31.29 43.26 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 179.754 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 39.7 mttm -68.39 -55.43 12.0 Favored 'General case' 0 CA--C 1.468 -2.206 0 C-N-CA 123.172 0.589 . . . . 0.0 110.309 176.822 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.481 HD23 ' CE3' ' A' ' 103' ' ' TRP . 80.9 mt -64.32 -32.83 74.59 Favored 'General case' 0 C--N 1.275 -2.635 0 CA-C-N 114.885 -1.052 . . . . 0.0 112.196 -176.076 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.404 ' O ' ' HA ' ' A' ' 105' ' ' THR . 10.3 t -78.02 -25.87 14.41 Favored 'Isoleucine or valine' 0 N--CA 1.401 -2.89 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.247 175.096 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 14.7 t -81.38 -33.87 32.03 Favored 'General case' 0 C--N 1.295 -1.787 0 O-C-N 121.425 -0.797 . . . . 0.0 109.086 178.535 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' TRP . . . . . 0.629 ' CD1' ' HA ' ' A' ' 6' ' ' ALA . 50.3 m0 -79.93 -45.04 19.25 Favored 'General case' 0 N--CA 1.429 -1.489 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.426 -178.118 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 33.5 m-85 -128.99 -4.05 5.09 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 115.241 1.571 . . . . 0.0 115.241 -174.383 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.404 ' HA ' ' O ' ' A' ' 101' ' ' VAL 0.279 7.9 p 58.3 167.28 0.05 OUTLIER 'General case' 0 N--CA 1.42 -1.931 0 N-CA-C 116.211 1.93 . . . . 0.0 116.211 -174.941 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 30.2 tp -92.4 157.24 16.7 Favored 'General case' 0 C--N 1.281 -2.411 0 CA-C-N 114.09 -1.414 . . . . 0.0 107.438 176.764 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.532 ' HG3' ' HB2' ' A' ' 66' ' ' ASP . 62.8 mmm -74.17 156.37 37.39 Favored 'General case' 0 CA--C 1.49 -1.352 0 CA-C-O 121.775 0.798 . . . . 0.0 110.428 174.553 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -89.32 153.56 20.78 Favored 'General case' 0 N--CA 1.394 -3.242 0 CA-C-N 114.32 -1.309 . . . . 0.0 109.2 -179.037 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 101.41 -29.97 11.39 Favored Glycine 0 N--CA 1.415 -2.719 0 C-N-CA 119.873 -1.156 . . . . 0.0 110.965 -176.563 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -117.14 177.09 4.84 Favored 'General case' 0 N--CA 1.421 -1.904 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -135.09 160.31 68.77 Favored Pre-proline 0 C--N 1.298 -1.661 0 N-CA-C 106.925 -1.509 . . . . 0.0 106.925 -178.36 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -55.99 122.66 12.16 Favored 'Trans proline' 0 CA--C 1.459 -3.256 0 C-N-CA 122.723 2.282 . . . . 0.0 111.054 177.611 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.416 ' HB ' ' HB3' ' A' ' 32' ' ' LEU . 33.8 mt -79.63 105.93 9.9 Favored 'Isoleucine or valine' 1 N--CA 1.379 -4.002 0 CA-C-N 113.05 -1.887 . . . . 0.0 106.957 -179.375 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -98.22 129.97 44.95 Favored 'General case' 0 C--N 1.266 -3.065 0 CA-C-O 121.913 0.863 . . . . 0.0 110.767 -178.453 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.541 ' NE ' ' HA ' ' A' ' 115' ' ' ARG . 4.0 mmp_? -124.33 -174.47 3.02 Favored 'General case' 0 N--CA 1.395 -3.209 0 N-CA-C 105.111 -2.181 . . . . 0.0 105.111 176.552 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 61.3 pttt -153.01 173.85 14.9 Favored 'General case' 0 C--N 1.254 -3.566 0 C-N-CA 119.822 -0.751 . . . . 0.0 109.658 -177.662 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.406 HG21 ' O ' ' A' ' 25' ' ' ARG . 21.4 t -66.54 138.26 23.3 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.791 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 172.613 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 27.9 m -84.71 175.72 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.267 -2.998 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.627 -174.191 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -98.88 6.45 46.79 Favored 'General case' 0 C--N 1.294 -1.813 0 CA-C-N 115.01 -0.995 . . . . 0.0 111.178 -179.155 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 . . . . . 0 C--N 1.304 -1.374 0 CA-C-N 113.794 -1.548 . . . . 0.0 107.618 176.813 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.421 ' SD ' ' N ' ' A' ' 2' ' ' ALA . 0.0 OUTLIER . . . . . 0 CA--C 1.515 -0.392 0 N-CA-C 105.044 -2.206 . . . . 0.0 105.044 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.421 ' N ' ' SD ' ' A' ' 1' ' ' MET . . . 66.92 36.71 4.23 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-O 122.248 1.023 . . . . 0.0 108.666 -175.324 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -63.1 147.34 51.06 Favored 'General case' 0 C--O 1.252 1.188 0 CA-C-N 113.333 -1.758 . . . . 0.0 110.089 -178.417 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -88.58 -68.91 1.27 Allowed Glycine 0 N--CA 1.435 -1.422 0 N-CA-C 111.32 -0.712 . . . . 0.0 111.32 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -167.8 109.06 0.32 Allowed Glycine 0 N--CA 1.437 -1.298 0 N-CA-C 111.232 -0.747 . . . . 0.0 111.232 178.182 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -137.71 165.45 26.38 Favored 'General case' 0 C--N 1.301 -1.504 0 CA-C-N 116.889 0.345 . . . . 0.0 110.58 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.466 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . -79.22 172.9 13.16 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.525 -179.591 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.66 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 15.0 t70 -67.4 145.47 55.02 Favored 'General case' 0 CA--C 1.483 -1.605 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 175.199 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.407 ' O ' ' HG2' ' A' ' 13' ' ' ARG . 38.1 mt -55.07 -41.79 71.96 Favored 'General case' 0 CA--C 1.494 -1.18 0 CA-C-N 119.03 0.832 . . . . 0.0 110.234 -177.847 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -69.0 -35.9 77.22 Favored 'General case' 0 CA--C 1.494 -1.206 0 CA-C-N 114.461 -1.245 . . . . 0.0 109.989 -177.654 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.5 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 5.4 m -65.2 -52.37 55.15 Favored 'General case' 0 N--CA 1.389 -3.522 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.028 177.042 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.66 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 79.1 mt-30 -49.31 -54.07 18.84 Favored 'General case' 0 CA--C 1.504 -0.806 0 C-N-CA 124.444 1.097 . . . . 0.0 111.934 -177.882 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.407 ' HG2' ' O ' ' A' ' 9' ' ' LEU . 10.7 ptt180 -64.01 -43.46 95.55 Favored 'General case' 0 N--CA 1.434 -1.256 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.646 -174.29 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 44.7 m -69.27 -44.52 71.71 Favored 'General case' 0 C--N 1.288 -2.07 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.244 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -63.81 -37.54 87.75 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.023 0.929 . . . . 0.0 109.962 -175.461 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.529 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 34.7 mm -78.97 -37.45 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.164 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.299 177.8 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.72 -36.71 77.11 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 -178.146 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 1.3 m -62.48 -32.95 73.93 Favored 'General case' 0 N--CA 1.412 -2.353 0 C-N-CA 124.786 1.234 . . . . 0.0 111.757 177.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 69.0 mt -85.86 -14.01 46.24 Favored 'General case' 0 C--N 1.278 -2.53 0 O-C-N 121.251 -0.906 . . . . 0.0 111.7 -177.425 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 14.3 mt -84.67 -26.13 27.99 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 177.113 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.406 ' H ' ' HG3' ' A' ' 21' ' ' LYS . 0.1 OUTLIER -91.39 -13.95 31.51 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-O 122.275 1.036 . . . . 0.0 111.348 -176.859 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 5.6 m -72.33 145.06 48.05 Favored 'General case' 0 N--CA 1.402 -2.869 0 CA-C-N 113.67 -1.604 . . . . 0.0 109.386 173.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.7 t -100.58 161.68 13.44 Favored 'General case' 0 N--CA 1.401 -2.891 0 CA-C-O 121.7 0.762 . . . . 0.0 110.628 -176.351 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.651 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP . 0.5 OUTLIER -99.46 167.68 10.46 Favored 'General case' 0 C--N 1.294 -1.826 0 CA-C-N 114.57 -1.196 . . . . 0.0 112.829 179.782 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -104.88 -157.45 0.61 Allowed 'General case' 0 C--N 1.291 -1.948 0 N-CA-C 105.939 -1.874 . . . . 0.0 105.939 176.559 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.46 ' C ' HG21 ' A' ' 117' ' ' VAL . 16.1 ptpt -119.39 29.98 7.35 Favored 'General case' 0 N--CA 1.414 -2.259 0 CA-C-O 121.478 0.656 . . . . 0.0 110.352 172.095 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.502 ' N ' HG21 ' A' ' 117' ' ' VAL . . . -149.78 20.34 1.14 Allowed Glycine 0 CA--C 1.54 1.618 0 CA-C-N 114.831 -1.077 . . . . 0.0 114.165 176.223 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.441 ' H ' HG11 ' A' ' 117' ' ' VAL . 10.9 m-20 -96.15 -174.48 3.1 Favored 'General case' 0 N--CA 1.491 1.588 0 CA-C-N 118.544 1.172 . . . . 0.0 110.055 -178.752 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.405 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 90.1 m -133.71 127.44 32.84 Favored 'General case' 0 N--CA 1.425 -1.698 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 170.953 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.651 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 17.1 m95 -114.33 163.72 14.9 Favored 'General case' 0 C--N 1.277 -2.584 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.453 ' HB2' ' HB2' ' A' ' 97' ' ' TRP . 89.1 m-85 -123.46 141.87 51.57 Favored 'General case' 0 C--N 1.278 -2.505 0 C-N-CA 121.069 -0.252 . . . . 0.0 111.507 -175.605 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.618 HD13 HG22 ' A' ' 113' ' ' ILE . 5.5 mp -92.04 134.64 34.63 Favored 'General case' 0 CA--C 1.461 -2.452 0 O-C-N 124.54 1.15 . . . . 0.0 111.512 -179.71 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.438 HG12 ' O ' ' A' ' 34' ' ' ASP . 95.8 t -116.52 142.65 29.21 Favored 'Isoleucine or valine' 0 C--N 1.251 -3.69 0 N-CA-C 102.932 -2.988 . . . . 0.0 102.932 171.853 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.438 ' O ' HG12 ' A' ' 33' ' ' VAL . 10.2 p-10 -72.75 136.7 45.55 Favored 'General case' 0 C--N 1.278 -2.541 0 N-CA-C 106.897 -1.52 . . . . 0.0 106.897 174.004 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 61.9 p -62.3 -28.36 69.68 Favored 'General case' 0 C--N 1.272 -2.802 0 CA-C-N 114.278 -1.328 . . . . 0.0 110.024 -173.092 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.9 mmt85 -69.96 -45.78 66.67 Favored 'General case' 0 N--CA 1.423 -1.824 0 CA-C-N 114.02 -1.446 . . . . 0.0 110.058 -173.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.522 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 69.1 t90 -67.61 -44.19 78.65 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 179.36 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.446 ' CG ' HD12 ' A' ' 90' ' ' ILE . 38.4 t80 -61.86 -37.83 85.99 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.185 -178.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -73.78 -23.66 59.73 Favored 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 121.693 -0.629 . . . . 0.0 112.627 178.563 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.522 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 5.9 tp-100 -70.29 -42.61 71.84 Favored 'General case' 0 N--CA 1.412 -2.341 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 172.114 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.447 ' O ' HG22 ' A' ' 45' ' ' VAL . 78.4 t90 -62.31 -39.39 92.88 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-N 114.241 -1.345 . . . . 0.0 110.529 176.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.535 ' HG2' ' CD2' ' A' ' 47' ' ' PHE . 11.5 mtpp -55.57 -46.77 77.16 Favored 'General case' 0 CA--C 1.498 -1.032 0 C-N-CA 123.265 0.626 . . . . 0.0 111.683 178.475 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -57.66 -52.5 65.19 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 124.766 1.291 . . . . 0.0 110.727 178.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.649 ' HB2' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -60.61 -36.42 78.56 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 113.594 -1.639 . . . . 0.0 114.226 -175.241 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.447 HG22 ' O ' ' A' ' 41' ' ' TRP . 18.8 m -95.95 -17.26 6.99 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.781 0 N-CA-C 113.234 0.827 . . . . 0.0 113.234 -178.842 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.568 ' HA2' ' CB ' ' A' ' 52' ' ' LYS . . . 79.79 38.12 20.92 Favored Glycine 0 N--CA 1.4 -3.743 0 C-N-CA 119.949 -1.12 . . . . 0.0 110.967 -172.698 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.535 ' CD2' ' HG2' ' A' ' 42' ' ' LYS . 75.9 t80 -63.22 -40.43 97.44 Favored 'General case' 0 N--CA 1.442 -0.827 0 C-N-CA 123.022 0.529 . . . . 0.0 111.562 -176.689 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.663 ' HB3' ' HB3' ' A' ' 51' ' ' ASP . 3.5 t70 -92.3 -178.95 5.09 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 -174.796 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' SER . . . . . 0.463 ' O ' ' HE2' ' A' ' 52' ' ' LYS . 20.8 m -84.94 -37.17 20.85 Favored 'General case' 0 C--N 1.294 -1.822 0 N-CA-C 111.755 0.279 . . . . 0.0 111.755 -176.696 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 66.7 p-90 -105.13 -21.14 13.32 Favored 'General case' 0 N--CA 1.39 -3.471 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 -178.344 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.663 ' HB3' ' HB3' ' A' ' 48' ' ' ASP . 31.7 t0 -94.98 73.29 3.46 Favored 'General case' 0 CA--C 1.461 -2.449 0 CA-C-N 114.071 -1.422 . . . . 0.0 108.776 -170.839 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.568 ' CB ' ' HA2' ' A' ' 46' ' ' GLY . 65.2 pttt -162.39 9.68 0.06 Allowed 'General case' 0 N--CA 1.415 -2.192 0 CA-C-N 112.689 -2.051 . . . . 0.0 114.058 -174.769 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -63.53 -22.9 67.15 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-O 122.639 1.209 . . . . 0.0 108.101 171.719 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.472 ' HB3' HG11 ' A' ' 60' ' ' VAL . 4.5 mt-30 -94.48 11.34 31.13 Favored 'General case' 0 N--CA 1.427 -1.594 0 CA-C-N 113.426 -1.715 . . . . 0.0 110.858 -175.817 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 46.5 ttm -62.11 115.13 3.85 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 110.067 -0.345 . . . . 0.0 110.067 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.03 20.55 77.5 Favored Glycine 0 N--CA 1.44 -1.094 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.824 -179.186 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.525 ' HB3' HG22 ' A' ' 60' ' ' VAL . 5.7 t0 -91.83 147.6 22.86 Favored 'General case' 0 CA--C 1.503 -0.846 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 -179.302 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.442 ' O ' ' HD2' ' A' ' 61' ' ' TYR . 19.4 pt20 -83.21 -17.56 42.35 Favored 'General case' 0 C--N 1.296 -1.72 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 -62.39 -25.26 67.83 Favored 'General case' 0 CA--C 1.492 -1.27 0 CA-C-N 115.043 -0.981 . . . . 0.0 111.41 177.699 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.649 HG23 ' HB2' ' A' ' 44' ' ' TYR . 26.5 m -121.19 7.44 6.07 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.824 0 CA-C-N 115.028 -0.987 . . . . 0.0 112.099 -172.401 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.442 ' HD2' ' O ' ' A' ' 58' ' ' GLN . 0.9 OUTLIER -62.73 116.53 24.41 Favored Pre-proline 0 C--N 1.305 -1.342 0 O-C-N 124.052 0.845 . . . . 0.0 111.067 -178.419 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 61' ' ' TYR . 15.0 Cg_endo -89.78 117.97 0.75 Allowed 'Trans proline' 0 N--CA 1.41 -3.399 0 C-N-CA 122.699 2.266 . . . . 0.0 111.422 177.555 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -73.45 -153.67 2.64 Favored Glycine 0 C--N 1.273 -2.95 0 CA-C-N 113.806 -1.543 . . . . 0.0 111.253 171.046 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.4 ' HB2' ' SD ' ' A' ' 107' ' ' MET . 52.3 Cg_exo -55.83 143.06 82.76 Favored 'Trans proline' 0 C--O 1.245 0.859 0 C-N-CA 122.82 2.347 . . . . 0.0 112.662 -178.547 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.444 HD11 ' HB3' ' A' ' 100' ' ' LEU . 42.2 mt -64.95 114.07 2.3 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.115 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.82 -176.768 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.582 ' HB2' ' HG3' ' A' ' 107' ' ' MET . 24.4 t70 -113.35 104.96 12.83 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 116.022 -0.535 . . . . 0.0 109.769 178.687 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -91.22 19.51 5.84 Favored 'General case' 0 C--N 1.303 -1.419 0 CA-C-N 116.925 -0.125 . . . . 0.0 111.245 -176.12 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 33.2 t -54.75 -31.66 58.8 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -176.004 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -66.06 -18.25 66.62 Favored Glycine 0 CA--C 1.527 0.79 0 C-N-CA 121.296 -0.478 . . . . 0.0 113.446 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 32.1 mt -93.61 -21.61 19.3 Favored 'General case' 0 C--O 1.247 0.928 0 CA-C-O 121.395 0.617 . . . . 0.0 109.388 179.678 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.555 HD13 ' HA ' ' A' ' 76' ' ' ALA . 50.3 mt -79.87 137.6 36.97 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.713 -173.625 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -78.43 -174.62 3.87 Favored 'General case' 0 C--O 1.246 0.891 0 CA-C-O 122.264 1.031 . . . . 0.0 111.135 178.24 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -95.25 93.79 7.5 Favored 'General case' 0 N--CA 1.423 -1.825 0 N-CA-C 106.142 -1.799 . . . . 0.0 106.142 172.129 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 179.27 -64.95 0.08 OUTLIER Glycine 0 N--CA 1.425 -2.075 0 N-CA-C 110.012 -1.235 . . . . 0.0 110.012 -177.58 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -148.37 170.59 17.62 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 177.408 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.555 ' HA ' HD13 ' A' ' 71' ' ' LEU . . . -83.66 2.04 39.5 Favored 'General case' 0 C--N 1.3 -1.572 0 CA-C-O 121.939 0.876 . . . . 0.0 109.629 177.681 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 23.2 mm-40 -114.94 3.13 14.45 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.238 178.603 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 94.7 p -98.13 113.04 24.81 Favored 'General case' 0 C--N 1.297 -1.683 0 CA-C-N 115.164 -0.926 . . . . 0.0 111.343 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.593 HD11 HG21 ' A' ' 113' ' ' ILE . 3.0 mm? -93.68 141.87 28.0 Favored 'General case' 0 N--CA 1.425 -1.705 0 C-N-CA 123.867 0.867 . . . . 0.0 111.459 -179.667 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -61.69 139.27 58.32 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.318 0.58 . . . . 0.0 111.163 175.179 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.566 ' H ' ' CD ' ' A' ' 81' ' ' GLU . 0.4 OUTLIER -58.56 -48.07 82.11 Favored 'General case' 0 C--N 1.301 -1.501 0 C-N-CA 124.838 1.255 . . . . 0.0 110.139 -176.445 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 71.9 m80 -84.85 12.06 8.11 Favored 'General case' 0 C--N 1.295 -1.793 0 CA-C-N 113.971 -1.468 . . . . 0.0 114.053 -170.703 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 74.9 mt -60.49 119.59 8.32 Favored 'General case' 0 C--O 1.24 0.604 0 CA-C-O 120.879 0.371 . . . . 0.0 111.965 178.354 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.74 HG21 HD12 ' A' ' 87' ' ' LEU . 51.2 mt -98.89 171.78 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.434 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 173.514 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.589 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 24.0 t70 -62.87 -139.08 0.0 OUTLIER 'General case' 0 C--O 1.185 -2.292 0 C-N-CA 125.183 1.393 . . . . 0.0 111.497 -177.864 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.687 ' HA ' ' O ' ' A' ' 89' ' ' TYR 0.271 1.0 OUTLIER -40.72 -20.54 0.01 OUTLIER 'General case' 0 N--CA 1.535 3.799 0 N-CA-C 117.018 2.229 . . . . 0.0 117.018 -173.192 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.74 HD12 HG21 ' A' ' 84' ' ' ILE . 66.1 mt -60.81 -57.98 10.37 Favored 'General case' 0 C--N 1.281 -2.39 0 C-N-CA 124.124 0.97 . . . . 0.0 109.645 171.208 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.527 ' HB2' ' O ' ' A' ' 84' ' ' ILE . 10.2 m-20 -97.86 -49.21 4.89 Favored 'General case' 0 CA--C 1.491 -1.295 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.06 -178.659 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' TYR . . . . . 0.687 ' O ' ' HA ' ' A' ' 86' ' ' GLU . 5.4 p90 -135.39 -165.87 1.75 Allowed 'General case' 0 C--O 1.16 -3.62 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 -175.214 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.555 ' O ' ' HA ' ' A' ' 32' ' ' LEU . 9.0 mt -147.05 149.75 15.4 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.316 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 169.261 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.531 HD21 ' CD1' ' A' ' 32' ' ' LEU . 37.2 mt -118.56 122.16 41.96 Favored 'General case' 0 N--CA 1.412 -2.34 0 O-C-N 124.453 1.096 . . . . 0.0 112.432 178.548 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.477 HD12 ' N ' ' A' ' 92' ' ' LEU . 1.7 mp -129.88 157.56 76.44 Favored Pre-proline 0 C--N 1.3 -1.546 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 -178.35 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -63.77 169.56 9.95 Favored 'Trans proline' 0 CA--C 1.5 -1.204 0 C-N-CA 122.442 2.095 . . . . 0.0 110.243 176.205 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 18.5 m -36.71 -56.4 0.84 Allowed 'General case' 0 C--N 1.322 -0.601 0 O-C-N 124.611 1.194 . . . . 0.0 110.738 170.398 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -59.2 -36.86 76.11 Favored 'General case' 0 C--O 1.199 -1.575 0 C-N-CA 124.812 1.245 . . . . 0.0 112.392 -174.561 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.596 ' O ' HD22 ' A' ' 100' ' ' LEU . . . -59.02 -62.74 5.88 Favored Glycine 0 N--CA 1.423 -2.23 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 179.363 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.453 ' HB2' ' HB2' ' A' ' 31' ' ' TYR . 68.8 t-105 -52.69 -49.79 64.6 Favored 'General case' 0 C--N 1.315 -0.893 0 C-N-CA 124.717 1.207 . . . . 0.0 110.488 177.686 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.481 ' O ' ' HB2' ' A' ' 102' ' ' SER . 34.4 t30 -53.49 -31.49 46.13 Favored 'General case' 0 N--CA 1.419 -2.014 0 C-N-CA 126.787 2.035 . . . . 0.0 111.962 178.339 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 52.7 mttm -78.22 -49.57 13.51 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-N 118.103 0.41 . . . . 0.0 110.402 174.638 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.596 HD22 ' O ' ' A' ' 96' ' ' GLY . 1.0 OUTLIER -57.4 -42.72 82.79 Favored 'General case' 0 C--O 1.24 0.567 0 CA-C-O 121.476 0.655 . . . . 0.0 111.362 -179.484 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 49.1 t -71.66 -27.99 29.79 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.809 0 C-N-CA 123.768 0.827 . . . . 0.0 111.091 177.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' SER . . . . . 0.481 ' HB2' ' O ' ' A' ' 98' ' ' ASN . 22.7 t -71.23 -34.08 70.46 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 178.65 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' TRP . . . . . . . . . . . . . 41.1 m0 -83.96 -54.0 5.17 Favored 'General case' 0 N--CA 1.423 -1.811 0 CA-C-N 115.266 -0.879 . . . . 0.0 112.239 -175.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -127.51 10.72 6.73 Favored 'General case' 0 CA--C 1.502 -0.88 0 N-CA-C 114.359 1.244 . . . . 0.0 114.359 -173.423 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 24.8 p 56.64 172.0 0.04 OUTLIER 'General case' 0 N--CA 1.411 -2.385 0 N-CA-C 116.774 2.139 . . . . 0.0 116.774 178.313 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.07 153.37 17.68 Favored 'General case' 0 C--N 1.282 -2.337 0 N-CA-C 105.831 -1.914 . . . . 0.0 105.831 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.582 ' HG3' ' HB2' ' A' ' 66' ' ' ASP . 65.3 mmm -64.62 156.17 30.94 Favored 'General case' 0 CA--C 1.493 -1.225 0 CA-C-O 121.299 0.571 . . . . 0.0 110.348 173.418 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -74.78 149.03 39.86 Favored 'General case' 0 N--CA 1.407 -2.609 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.043 -179.201 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 83.47 -34.55 2.89 Favored Glycine 0 N--CA 1.423 -2.183 0 CA-C-N 115.251 -0.886 . . . . 0.0 112.109 -178.258 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -79.0 150.67 31.89 Favored 'General case' 0 N--CA 1.411 -2.395 0 CA-C-O 121.302 0.573 . . . . 0.0 111.116 179.481 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -133.01 146.42 61.19 Favored Pre-proline 0 N--CA 1.406 -2.646 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -48.63 128.39 18.17 Favored 'Trans proline' 0 CA--C 1.467 -2.825 0 C-N-CA 124.097 3.198 . . . . 0.0 114.544 -174.339 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.618 HG22 HD13 ' A' ' 32' ' ' LEU . 45.9 mt -85.21 107.47 16.08 Favored 'Isoleucine or valine' 1 N--CA 1.371 -4.384 0 CA-C-N 113.28 -1.782 . . . . 0.0 106.879 175.809 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.405 ' HB1' ' CG2' ' A' ' 29' ' ' THR . . . -103.86 135.64 45.03 Favored 'General case' 0 C--N 1.275 -2.656 0 CA-C-O 121.446 0.641 . . . . 0.0 110.823 -178.491 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.531 ' HB2' HD11 ' A' ' 32' ' ' LEU . 13.2 tpt180 -136.25 126.97 27.26 Favored 'General case' 0 CA--C 1.455 -2.697 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 179.151 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.84 -176.27 3.82 Favored 'General case' 0 C--N 1.253 -3.622 0 CA-C-O 123.358 1.552 . . . . 0.0 112.125 179.186 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.577 HG12 ' HB2' ' A' ' 24' ' ' LEU . 9.0 m -66.71 -172.11 0.06 OUTLIER 'Isoleucine or valine' 1 N--CA 1.371 -4.394 0 CA-C-N 111.249 -2.705 . . . . 0.0 111.77 172.69 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 26.9 m -67.67 133.07 32.14 Favored 'Isoleucine or valine' 0 N--CA 1.395 -3.196 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.909 176.127 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -118.78 13.04 13.14 Favored 'General case' 0 C--N 1.275 -2.649 0 CA-C-O 123.033 1.397 . . . . 0.0 107.682 178.117 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 . . . . . 0 N--CA 1.427 -1.603 0 CA-C-N 112.527 -2.124 . . . . 0.0 111.057 -179.3 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.5 ptm . . . . . 0 CA--C 1.503 -0.862 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -132.32 9.48 4.4 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-O 122.547 1.165 . . . . 0.0 108.535 175.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -151.77 155.32 37.99 Favored 'General case' 0 C--N 1.285 -2.208 0 CA-C-N 113.457 -1.701 . . . . 0.0 107.195 -178.456 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 105.41 -133.42 11.57 Favored Glycine 0 N--CA 1.427 -1.964 0 C-N-CA 120.056 -1.069 . . . . 0.0 112.487 177.412 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 74.43 43.75 29.7 Favored Glycine 0 CA--C 1.483 -1.957 0 N-CA-C 107.088 -2.405 . . . . 0.0 107.088 -173.413 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.613 ' HA ' ' CD1' ' A' ' 103' ' ' TRP . . . -90.39 143.18 26.99 Favored 'General case' 0 N--CA 1.406 -2.641 0 CA-C-N 113.416 -1.392 . . . . 0.0 114.294 -169.709 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.588 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . -74.26 156.4 37.25 Favored 'General case' 0 N--CA 1.422 -1.844 0 CA-C-N 113.128 -1.851 . . . . 0.0 109.322 176.469 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.601 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 23.3 t70 -69.02 151.35 46.6 Favored 'General case' 0 C--O 1.194 -1.847 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 174.825 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -41.05 -52.49 3.18 Favored 'General case' 0 C--N 1.307 -1.258 0 C-N-CA 126.263 1.825 . . . . 0.0 112.447 177.373 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -68.91 -31.02 69.62 Favored 'General case' 0 C--N 1.271 -2.808 0 CA-C-N 113.593 -1.639 . . . . 0.0 110.221 -175.504 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.588 ' CG2' ' HB1' ' A' ' 7' ' ' ALA . 16.5 m -73.65 -44.3 57.18 Favored 'General case' 1 N--CA 1.377 -4.098 0 CA-C-N 114.57 -1.196 . . . . 0.0 110.786 177.847 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.601 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 45.9 mt-30 -56.78 -57.27 13.17 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 122.651 0.38 . . . . 0.0 111.589 -173.512 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.501 ' HB3' HG13 ' A' ' 45' ' ' VAL . 0.0 OUTLIER -52.95 -41.37 64.44 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-O 121.151 0.501 . . . . 0.0 112.165 177.029 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.5 m -69.72 -47.16 64.09 Favored 'General case' 0 C--N 1.291 -1.965 0 CA-C-N 115.668 -0.697 . . . . 0.0 111.572 -178.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.575 ' O ' ' HB ' ' A' ' 18' ' ' THR . 13.5 t70 -61.31 -43.75 98.36 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 124.487 1.115 . . . . 0.0 110.64 -178.079 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.61 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 32.0 mm -72.88 -37.26 54.0 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.998 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.055 -178.375 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.405 ' O ' ' HG3' ' A' ' 21' ' ' LYS . . . -61.6 -36.99 82.27 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.575 ' HB ' ' O ' ' A' ' 15' ' ' ASP . 6.3 m -62.15 -33.99 75.55 Favored 'General case' 0 N--CA 1.408 -2.549 0 C-N-CA 125.898 1.679 . . . . 0.0 111.741 178.314 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 73.5 mt -85.79 -13.95 46.64 Favored 'General case' 0 C--N 1.27 -2.875 0 O-C-N 121.258 -0.901 . . . . 0.0 111.886 -177.613 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.61 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 14.3 mt -86.33 -26.88 24.64 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.611 0.72 . . . . 0.0 109.485 177.376 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.405 ' HG3' ' O ' ' A' ' 17' ' ' ALA . 0.1 OUTLIER -89.36 -7.66 54.81 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-O 122.35 1.071 . . . . 0.0 111.659 -174.507 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 15.2 m -75.73 136.71 40.32 Favored 'General case' 0 N--CA 1.386 -3.625 0 CA-C-N 113.207 -1.815 . . . . 0.0 110.729 176.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.5 m -75.03 142.86 43.75 Favored 'General case' 0 N--CA 1.403 -2.809 0 CA-C-N 113.724 -1.58 . . . . 0.0 111.549 178.274 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.534 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP . 0.5 OUTLIER -98.52 179.56 4.66 Favored 'General case' 0 N--CA 1.423 -1.812 0 N-CA-C 114.228 1.196 . . . . 0.0 114.228 -178.312 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.584 ' O ' HG21 ' A' ' 117' ' ' VAL . 3.6 mmp_? -127.23 -145.52 0.32 Allowed 'General case' 0 C--O 1.203 -1.383 0 C-N-CA 123.466 0.706 . . . . 0.0 110.894 -172.694 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -119.24 122.46 41.99 Favored 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 171.512 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 68.23 36.53 85.17 Favored Glycine 0 C--O 1.224 -0.493 0 N-CA-C 110.857 -0.897 . . . . 0.0 110.857 -177.086 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.455 ' HB2' ' HB2' ' A' ' 25' ' ' ARG . 34.1 t70 -79.23 -8.68 59.22 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-O 121.786 0.803 . . . . 0.0 111.989 -174.509 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.471 ' HA ' ' HA ' ' A' ' 116' ' ' LYS . 25.9 m 49.55 110.2 0.0 OUTLIER 'General case' 0 C--N 1.282 -2.344 0 C-N-CA 127.159 2.184 . . . . 0.0 114.369 -176.147 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.534 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 13.1 m95 -114.25 134.62 54.81 Favored 'General case' 0 C--N 1.3 -1.564 0 CA-C-N 114.693 -1.14 . . . . 0.0 109.172 -178.903 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -104.44 147.96 26.97 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 111.367 0.136 . . . . 0.0 111.367 -174.287 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.667 ' HA ' ' O ' ' A' ' 90' ' ' ILE . 5.8 mp -93.24 144.85 24.9 Favored 'General case' 0 CA--C 1.491 -1.307 0 N-CA-C 114.328 1.232 . . . . 0.0 114.328 -175.761 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 75.4 t -131.11 140.94 47.34 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.715 0 N-CA-C 105.871 -1.9 . . . . 0.0 105.871 173.624 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.493 ' HA ' HD11 ' A' ' 70' ' ' LEU . 20.1 t0 -64.62 131.61 47.47 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 173.689 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.44 ' O ' ' HE3' ' A' ' 39' ' ' LYS . 47.6 t -59.79 -37.54 79.39 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.262 -176.347 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 88.5 mtm180 -68.48 -34.31 75.71 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.848 -174.459 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.485 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 65.3 t90 -66.11 -46.37 77.84 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 177.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.532 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 32.7 t80 -64.7 -41.63 95.88 Favored 'General case' 0 C--O 1.206 -1.187 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.135 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.494 ' HG3' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.27 -38.98 69.28 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 118.394 0.543 . . . . 0.0 111.868 173.394 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.485 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 5.8 tp-100 -65.58 -41.85 92.43 Favored 'General case' 0 N--CA 1.421 -1.906 0 CA-C-O 121.279 0.562 . . . . 0.0 109.854 175.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.4 ' HZ2' ' HB3' ' A' ' 12' ' ' GLN . 77.1 t90 -63.09 -39.68 95.43 Favored 'General case' 0 N--CA 1.437 -1.097 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.001 178.198 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.532 ' HG3' ' O ' ' A' ' 38' ' ' PHE . 35.8 mtmt -57.65 -40.08 78.48 Favored 'General case' 0 CA--C 1.515 -0.396 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 178.518 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -61.24 -48.63 80.57 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.884 0.849 . . . . 0.0 109.862 176.594 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.631 ' HB2' HG23 ' A' ' 60' ' ' VAL . 2.1 t80 -66.48 -41.92 88.22 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 113.548 -1.66 . . . . 0.0 112.709 -175.458 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.501 HG13 ' HB3' ' A' ' 13' ' ' ARG . 1.6 p -90.54 -15.99 8.37 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.05 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.789 -173.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.583 ' HA2' ' HB2' ' A' ' 52' ' ' LYS . . . 75.83 33.18 51.79 Favored Glycine 0 N--CA 1.416 -2.639 0 C-N-CA 121.249 -0.5 . . . . 0.0 112.119 -176.468 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.458 ' HB2' ' CG1' ' A' ' 45' ' ' VAL . 54.4 t80 -68.36 -45.48 72.68 Favored 'General case' 0 N--CA 1.44 -0.973 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.45 ' O ' ' HB3' ' A' ' 52' ' ' LYS . 70.2 m-20 -78.81 116.29 19.05 Favored 'General case' 0 CA--C 1.491 -1.29 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 178.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 36.0 m -66.63 -27.84 68.0 Favored 'General case' 0 C--N 1.291 -1.963 0 N-CA-C 111.8 0.296 . . . . 0.0 111.8 -178.022 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 45.0 p90 -82.57 -14.39 54.94 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.59 -178.852 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -154.53 101.06 2.31 Favored 'General case' 0 CA--C 1.488 -1.413 0 CA-C-O 121.417 0.627 . . . . 0.0 110.21 -179.076 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.583 ' HB2' ' HA2' ' A' ' 46' ' ' GLY . 22.8 pttp -156.91 21.41 0.32 Allowed 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 114.66 -1.154 . . . . 0.0 111.748 -171.387 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -70.79 -4.09 22.19 Favored 'General case' 0 C--N 1.266 -3.046 0 CA-C-N 114.503 -1.226 . . . . 0.0 110.177 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.436 ' HB3' HG11 ' A' ' 60' ' ' VAL . 0.2 OUTLIER -106.87 11.71 29.71 Favored 'General case' 0 N--CA 1.403 -2.779 0 C-N-CA 124.467 1.107 . . . . 0.0 109.167 -177.3 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 55' ' ' MET . . . . . 0.589 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 50.0 ttm -60.98 103.56 0.28 Allowed 'General case' 0 N--CA 1.428 -1.555 0 C-N-CA 123.837 0.855 . . . . 0.0 110.914 179.56 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 89.54 15.69 58.04 Favored Glycine 0 N--CA 1.439 -1.117 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.873 -178.236 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.579 ' HB3' HG22 ' A' ' 60' ' ' VAL . 29.3 t0 -89.89 142.89 27.27 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 179.7 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -82.82 -16.25 48.48 Favored 'General case' 0 C--N 1.296 -1.72 0 CA-C-O 122.358 1.075 . . . . 0.0 109.061 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 66.3 m-20 -62.51 -26.3 68.47 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 114.317 -1.311 . . . . 0.0 111.171 175.537 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.631 HG23 ' HB2' ' A' ' 44' ' ' TYR . 27.3 m -123.33 1.95 5.78 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.693 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.113 -172.565 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -66.37 119.56 63.35 Favored Pre-proline 0 C--N 1.299 -1.594 0 C-N-CA 119.426 -0.91 . . . . 0.0 110.495 -178.686 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -87.22 117.07 1.25 Allowed 'Trans proline' 0 N--CA 1.413 -3.257 0 C-N-CA 122.529 2.153 . . . . 0.0 110.22 177.769 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -71.47 -145.35 0.41 Allowed Glycine 0 C--N 1.267 -3.26 0 CA-C-N 113.875 -1.511 . . . . 0.0 112.779 177.144 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -54.62 135.71 67.86 Favored 'Trans proline' 0 C--O 1.253 1.27 0 C-N-CA 123.001 2.468 . . . . 0.0 112.822 -177.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.568 HD11 ' HB3' ' A' ' 100' ' ' LEU . 57.2 mt -70.04 107.18 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.927 0 CA-C-N 115.133 -0.94 . . . . 0.0 112.029 -176.402 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -95.97 128.4 42.83 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.115 175.66 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.512 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 35.1 m-80 -124.21 11.82 8.83 Favored 'General case' 0 C--N 1.315 -0.933 0 O-C-N 123.96 0.787 . . . . 0.0 110.412 -179.006 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 23.0 t -59.95 -30.16 68.89 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -173.824 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -76.09 -13.28 83.37 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 121.479 -0.391 . . . . 0.0 112.547 -178.271 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.493 HD11 ' HA ' ' A' ' 34' ' ' ASP . 37.4 mt -91.08 -20.48 22.01 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 67' ' ' ASN . 44.9 mt -83.96 159.11 21.32 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.237 -170.697 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.455 ' HG3' ' C ' ' A' ' 79' ' ' LEU . 58.1 mtpt -87.46 -173.48 4.38 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-O 121.804 0.811 . . . . 0.0 111.797 178.636 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -95.8 109.6 21.89 Favored 'General case' 0 C--N 1.293 -1.86 0 CA-C-N 114.776 -1.102 . . . . 0.0 108.618 -175.094 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 124.88 -49.59 0.9 Allowed Glycine 0 N--CA 1.44 -1.07 0 C-N-CA 120.311 -0.947 . . . . 0.0 112.192 177.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -120.97 136.69 54.91 Favored 'General case' 0 CA--C 1.478 -1.808 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.476 ' HA ' HD13 ' A' ' 71' ' ' LEU . . . -89.82 4.75 48.84 Favored 'General case' 0 C--N 1.295 -1.761 0 CA-C-O 122.151 0.977 . . . . 0.0 109.509 178.699 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -112.68 2.85 16.29 Favored 'General case' 0 C--N 1.303 -1.44 0 CA-C-O 122.242 1.02 . . . . 0.0 108.506 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.2 t -113.56 140.68 47.96 Favored 'General case' 0 C--N 1.287 -2.12 0 N-CA-C 106.364 -1.717 . . . . 0.0 106.364 177.581 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.505 ' HA ' ' HA ' ' A' ' 71' ' ' LEU . 1.0 OUTLIER -126.41 153.84 44.44 Favored 'General case' 0 N--CA 1.409 -2.495 0 C-N-CA 120.719 -0.392 . . . . 0.0 110.391 -174.49 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.61 ' HB2' HD13 ' A' ' 83' ' ' LEU . 66.2 mttm -55.25 144.23 25.34 Favored 'General case' 0 C--N 1.31 -1.144 0 N-CA-C 116.055 1.872 . . . . 0.0 116.055 -171.683 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -48.02 -58.24 4.71 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 127.218 2.207 . . . . 0.0 115.847 -172.868 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 41.4 m80 -91.84 -1.76 57.19 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 113.882 1.067 . . . . 0.0 113.882 -169.415 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.61 HD13 ' HB2' ' A' ' 80' ' ' LYS . 10.7 mp -59.98 127.5 32.21 Favored 'General case' 0 C--O 1.254 1.303 0 N-CA-C 115.307 1.595 . . . . 0.0 115.307 -176.796 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.65 HG21 HD12 ' A' ' 87' ' ' LEU . 61.8 mt -97.74 174.01 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 CA-C-N 112.67 -2.059 . . . . 0.0 107.029 177.876 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.517 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 18.3 t70 -61.59 -139.98 0.0 OUTLIER 'General case' 0 CA--C 1.581 2.173 0 C-N-CA 126.071 1.749 . . . . 0.0 110.684 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.63 ' HA ' ' O ' ' A' ' 89' ' ' TYR 0.252 0.2 OUTLIER -40.33 -18.86 0.01 OUTLIER 'General case' 0 N--CA 1.517 2.875 0 C-N-CA 127.333 2.253 . . . . 0.0 116.65 -171.811 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.65 HD12 HG21 ' A' ' 84' ' ' ILE . 54.7 mt -65.18 -59.15 4.41 Favored 'General case' 0 C--N 1.274 -2.678 0 C-N-CA 124.638 1.175 . . . . 0.0 110.847 172.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.417 ' HB3' ' HG ' ' A' ' 83' ' ' LEU . 36.4 m-20 -97.12 -39.18 9.43 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.709 -175.924 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' TYR . . . . . 0.63 ' O ' ' HA ' ' A' ' 86' ' ' GLU . 2.6 p90 -145.05 -164.34 1.91 Allowed 'General case' 0 C--O 1.162 -3.511 0 N-CA-C 105.172 -2.158 . . . . 0.0 105.172 -177.344 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.667 ' O ' ' HA ' ' A' ' 32' ' ' LEU . 3.1 mt -144.85 150.94 15.72 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.313 0 CA-C-N 120.25 1.386 . . . . 0.0 108.767 171.848 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.545 HD21 ' CD1' ' A' ' 32' ' ' LEU . 26.4 mt -119.98 117.98 29.47 Favored 'General case' 0 N--CA 1.393 -3.286 0 O-C-N 124.444 1.09 . . . . 0.0 110.936 175.829 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.513 ' HB3' ' HA3' ' A' ' 96' ' ' GLY . 1.2 mm? -111.95 161.14 27.15 Favored Pre-proline 0 CA--C 1.487 -1.48 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 177.334 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -59.78 168.22 5.87 Favored 'Trans proline' 0 C--O 1.257 1.432 0 C-N-CA 121.886 1.724 . . . . 0.0 108.158 165.246 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 34.1 m -50.89 -40.48 56.79 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 177.214 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.463 ' O ' ' HG2' ' A' ' 99' ' ' LYS . 6.3 mm-40 -57.12 -52.71 64.19 Favored 'General case' 0 C--O 1.198 -1.635 0 C-N-CA 124.021 0.929 . . . . 0.0 111.522 177.048 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.544 ' O ' HD22 ' A' ' 100' ' ' LEU . . . -54.23 -57.61 16.2 Favored Glycine 0 CA--C 1.495 -1.211 0 O-C-N 124.049 0.843 . . . . 0.0 112.082 -175.033 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 47.8 t-105 -53.66 -51.02 64.49 Favored 'General case' 0 C--N 1.289 -2.027 0 C-N-CA 123.512 0.725 . . . . 0.0 111.287 174.658 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -55.03 -28.79 54.9 Favored 'General case' 0 C--O 1.195 -1.782 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 175.464 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.644 ' HB3' ' CH2' ' A' ' 103' ' ' TRP . 19.0 mmtp -69.76 -57.14 5.47 Favored 'General case' 0 N--CA 1.41 -2.465 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 177.257 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.568 ' HB3' HD11 ' A' ' 65' ' ' ILE . 0.5 OUTLIER -58.88 -39.22 80.74 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.918 -176.94 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.523 ' O ' ' HA ' ' A' ' 105' ' ' THR . 55.2 t -75.6 -26.71 18.36 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.377 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.817 177.268 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 25.9 t -73.73 -39.08 64.53 Favored 'General case' 0 C--N 1.296 -1.725 0 O-C-N 120.96 -1.087 . . . . 0.0 108.583 176.138 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' TRP . . . . . 0.644 ' CH2' ' HB3' ' A' ' 99' ' ' LYS . 26.1 m0 -79.35 -49.51 12.29 Favored 'General case' 0 N--CA 1.437 -1.097 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.954 -174.369 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 64.5 m-85 -126.84 8.62 6.85 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 114.108 1.151 . . . . 0.0 114.108 -176.792 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.523 ' HA ' ' O ' ' A' ' 101' ' ' VAL 0.268 6.0 t 49.63 -174.58 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 126.608 1.963 . . . . 0.0 115.584 179.538 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -98.34 157.43 16.19 Favored 'General case' 0 C--N 1.247 -3.862 0 CA-C-N 112.733 -2.031 . . . . 0.0 107.45 -174.421 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 23.2 tpp -74.57 137.96 42.73 Favored 'General case' 1 N--CA 1.369 -4.475 0 CA-C-O 121.749 0.785 . . . . 0.0 109.311 175.372 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -63.35 123.49 18.83 Favored 'General case' 1 N--CA 1.362 -4.844 0 C-N-CA 126.188 1.795 . . . . 0.0 110.583 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 107.97 -15.25 37.12 Favored Glycine 0 N--CA 1.421 -2.31 0 CA-C-N 113.809 -1.541 . . . . 0.0 111.039 -177.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -104.02 156.74 17.61 Favored 'General case' 0 N--CA 1.434 -1.23 0 CA-C-O 121.885 0.85 . . . . 0.0 112.426 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -134.72 141.31 38.18 Favored Pre-proline 0 C--N 1.292 -1.919 0 N-CA-C 106.119 -1.808 . . . . 0.0 106.119 -177.82 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -48.73 125.34 12.57 Favored 'Trans proline' 0 CA--C 1.47 -2.684 0 C-N-CA 123.962 3.108 . . . . 0.0 115.263 -172.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.49 HG12 HD21 ' A' ' 71' ' ' LEU . 3.7 mp -90.73 109.22 20.64 Favored 'Isoleucine or valine' 1 N--CA 1.377 -4.092 0 CA-C-N 112.411 -2.177 . . . . 0.0 106.011 177.43 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -108.69 138.74 44.53 Favored 'General case' 0 C--N 1.281 -2.387 0 CA-C-O 121.927 0.87 . . . . 0.0 112.397 -177.546 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.563 ' HG3' HD11 ' A' ' 32' ' ' LEU . 11.8 mmm180 -120.57 -172.12 2.31 Favored 'General case' 0 C--N 1.282 -2.346 0 N-CA-C 104.126 -2.546 . . . . 0.0 104.126 173.031 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' LYS . . . . . 0.471 ' HA ' ' HA ' ' A' ' 29' ' ' THR . 24.4 pttm -135.48 -167.31 1.99 Allowed 'General case' 0 C--N 1.247 -3.871 0 N-CA-C 107.353 -1.351 . . . . 0.0 107.353 176.167 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.584 HG21 ' O ' ' A' ' 25' ' ' ARG . 59.4 t -60.26 134.22 25.59 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.291 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 171.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' VAL . . . . . 0.401 HG22 ' H ' ' A' ' 118' ' ' VAL . 19.2 m -73.6 -178.82 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.271 -2.813 0 N-CA-C 115.568 1.692 . . . . 0.0 115.568 -166.595 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -57.85 -44.04 86.29 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-N 114.015 -1.448 . . . . 0.0 111.431 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 19.7 pt20 . . . . . 0 C--O 1.248 1.021 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.712 -176.552 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.2 mtt . . . . . 0 CA--C 1.503 -0.842 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -143.71 98.15 3.19 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 176.194 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -93.88 114.56 26.81 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 -179.175 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -78.39 74.99 2.0 Favored Glycine 0 C--N 1.309 -0.945 0 CA-C-N 116.251 -0.431 . . . . 0.0 112.687 -177.542 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -144.04 57.27 0.54 Allowed Glycine 0 CA--C 1.488 -1.653 0 N-CA-C 110.707 -0.957 . . . . 0.0 110.707 178.057 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.59 ' HA ' ' CD1' ' A' ' 103' ' ' TRP . . . -106.31 144.78 32.51 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-O 121.596 0.712 . . . . 0.0 111.868 -178.133 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.509 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . -68.77 172.93 5.72 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 113.879 -1.51 . . . . 0.0 111.307 178.584 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.51 ' O ' ' HB ' ' A' ' 11' ' ' THR . 21.2 t70 -74.7 149.25 39.95 Favored 'General case' 0 C--O 1.199 -1.57 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.378 178.246 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.41 ' HA ' ' HG3' ' A' ' 12' ' ' GLN . 18.7 mt -51.43 -38.53 54.08 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.635 0.774 . . . . 0.0 111.2 -177.47 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -67.51 -38.65 84.59 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-N 113.684 -1.598 . . . . 0.0 109.227 -176.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.51 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 8.2 m -74.05 -48.3 30.83 Favored 'General case' 0 N--CA 1.38 -3.929 0 CA-C-N 113.604 -1.634 . . . . 0.0 110.597 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.457 ' HB3' ' HZ2' ' A' ' 41' ' ' TRP . 14.5 mt-30 -52.51 -54.29 34.52 Favored 'General case' 0 CA--C 1.48 -1.721 0 O-C-N 123.903 0.752 . . . . 0.0 110.561 -174.688 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.664 ' HD3' HG21 ' A' ' 45' ' ' VAL . 4.0 mmm180 -70.6 -32.32 69.62 Favored 'General case' 0 CA--C 1.452 -2.797 0 N-CA-C 115.627 1.714 . . . . 0.0 115.627 -176.081 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 33.8 t -72.02 -45.54 60.5 Favored 'General case' 0 C--N 1.273 -2.72 0 O-C-N 123.971 0.794 . . . . 0.0 110.063 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -70.45 -31.41 68.57 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.927 -175.679 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.543 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 3.7 mm -80.88 -42.97 20.71 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.714 0 CA-C-N 115.297 -0.865 . . . . 0.0 112.222 176.606 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.531 ' O ' ' HG2' ' A' ' 21' ' ' LYS . . . -55.47 -37.29 67.6 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.473 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.484 ' HA ' ' HD3' ' A' ' 21' ' ' LYS . 1.2 m -63.1 -34.55 77.83 Favored 'General case' 0 N--CA 1.405 -2.718 0 CA-C-N 113.75 -1.568 . . . . 0.0 112.276 -179.284 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.419 HD11 ' HE3' ' A' ' 99' ' ' LYS . 82.9 mt -86.09 -14.03 45.48 Favored 'General case' 0 C--N 1.275 -2.643 0 O-C-N 121.694 -0.629 . . . . 0.0 112.305 -176.89 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 20.4 mt -84.11 -28.24 27.63 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 178.233 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.531 ' HG2' ' O ' ' A' ' 17' ' ' ALA . 19.2 ptmt -88.47 -23.35 23.27 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 114.705 -1.134 . . . . 0.0 110.945 -175.356 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.2 m -57.4 141.55 46.89 Favored 'General case' 0 N--CA 1.404 -2.761 0 C-N-CA 125.24 1.416 . . . . 0.0 111.233 173.658 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.3 m -87.33 170.11 11.69 Favored 'General case' 0 N--CA 1.403 -2.777 0 CA-C-N 114.027 -1.442 . . . . 0.0 111.969 -176.27 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.639 ' HB2' HG12 ' A' ' 117' ' ' VAL . 0.7 OUTLIER -112.78 163.91 14.02 Favored 'General case' 0 N--CA 1.408 -2.569 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 178.003 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 28.3 mmt180 -104.59 -159.55 0.72 Allowed 'General case' 0 C--N 1.297 -1.675 0 CA-C-N 114.514 -1.221 . . . . 0.0 108.186 176.135 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -109.64 18.72 19.98 Favored 'General case' 0 N--CA 1.42 -1.963 0 N-CA-C 106.808 -1.552 . . . . 0.0 106.808 175.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.485 ' N ' HG21 ' A' ' 117' ' ' VAL . . . -155.85 29.65 0.6 Allowed Glycine 0 N--CA 1.427 -1.959 0 CA-C-N 114.284 -1.326 . . . . 0.0 112.915 179.182 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.46 ' HB2' ' CG1' ' A' ' 117' ' ' VAL . 57.2 m-20 -95.69 153.36 17.77 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 119.189 -1.004 . . . . 0.0 109.6 176.223 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 98.9 m -104.99 129.21 53.48 Favored 'General case' 0 C--N 1.287 -2.122 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 174.614 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.532 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 40.9 m95 -116.51 139.11 50.83 Favored 'General case' 0 C--N 1.297 -1.696 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -178.772 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.436 ' HB2' ' HB2' ' A' ' 97' ' ' TRP . 72.3 m-85 -104.92 141.78 35.94 Favored 'General case' 0 C--N 1.276 -2.63 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.305 -176.013 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.504 HD11 ' HB2' ' A' ' 115' ' ' ARG . 6.0 mp -89.65 136.87 32.78 Favored 'General case' 0 CA--C 1.49 -1.344 0 O-C-N 124.383 1.052 . . . . 0.0 111.513 179.67 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.449 HG12 ' O ' ' A' ' 34' ' ' ASP . 81.7 t -121.74 140.36 45.98 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.868 0 N-CA-C 104.41 -2.441 . . . . 0.0 104.41 172.339 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.481 ' OD2' ' HB2' ' A' ' 36' ' ' ARG . 5.5 p-10 -69.69 127.38 32.76 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 106.153 -1.795 . . . . 0.0 106.153 172.157 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 69.6 p -67.37 -19.19 65.39 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-O 121.565 0.698 . . . . 0.0 110.899 -172.407 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.481 ' HB2' ' OD2' ' A' ' 34' ' ' ASP . 44.5 mtt180 -63.9 -48.06 78.14 Favored 'General case' 0 C--N 1.285 -2.235 0 C-N-CA 125.51 1.524 . . . . 0.0 108.29 -177.023 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.464 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 73.6 t90 -63.84 -48.09 78.18 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 124.597 1.159 . . . . 0.0 108.803 177.808 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.423 ' CG ' HD12 ' A' ' 90' ' ' ILE . 23.3 t80 -61.86 -40.04 93.95 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 114.858 -1.064 . . . . 0.0 111.614 -177.631 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -67.02 -34.36 77.56 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 175.649 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.464 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 6.0 tp-100 -65.55 -42.39 91.94 Favored 'General case' 0 N--CA 1.423 -1.796 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 175.068 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.647 ' O ' HG22 ' A' ' 45' ' ' VAL . 47.8 t90 -66.04 -37.81 86.79 Favored 'General case' 0 N--CA 1.436 -1.14 0 CA-C-N 114.256 -1.338 . . . . 0.0 110.036 179.805 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.0 mtpp -53.72 -45.52 70.5 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.746 0.818 . . . . 0.0 113.177 175.195 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.47 ' HG2' ' OD2' ' A' ' 51' ' ' ASP . 51.5 mttm -65.31 -46.25 81.07 Favored 'General case' 0 CA--C 1.507 -0.676 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 177.977 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.453 ' HB2' HG23 ' A' ' 60' ' ' VAL . 3.5 t80 -55.29 -33.09 62.93 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 114.306 -1.315 . . . . 0.0 113.539 -179.448 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.664 HG21 ' HD3' ' A' ' 13' ' ' ARG . 5.7 m -102.45 -11.75 8.92 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -179.392 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.456 ' HA2' ' HB2' ' A' ' 52' ' ' LYS . . . 71.71 43.41 51.56 Favored Glycine 0 N--CA 1.415 -2.707 0 C-N-CA 120.003 -1.094 . . . . 0.0 111.554 -175.445 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -66.77 -45.1 79.57 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 176.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -83.44 153.87 24.25 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 115.225 -0.898 . . . . 0.0 108.958 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 5.4 p -84.51 -48.8 9.22 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-O 121.227 0.536 . . . . 0.0 111.921 -179.263 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 46.6 p90 -73.67 -16.6 61.21 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.752 -177.587 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.47 ' OD2' ' HG2' ' A' ' 43' ' ' LYS . 30.7 t70 -135.37 87.34 2.32 Favored 'General case' 0 CA--C 1.474 -1.954 0 CA-C-O 121.956 0.884 . . . . 0.0 111.159 -174.6 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.456 ' HB2' ' HA2' ' A' ' 46' ' ' GLY . 64.7 pttt -157.5 15.47 0.25 Allowed 'General case' 0 N--CA 1.429 -1.483 0 CA-C-N 113.835 -1.53 . . . . 0.0 112.236 -176.305 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 87.5 m-85 -64.1 -10.0 19.82 Favored 'General case' 0 C--N 1.292 -1.927 0 CA-C-N 114.922 -1.036 . . . . 0.0 110.356 173.465 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.59 ' HB3' HG11 ' A' ' 60' ' ' VAL . 19.3 mm-40 -100.72 3.23 42.12 Favored 'General case' 0 N--CA 1.405 -2.724 0 C-N-CA 125.396 1.478 . . . . 0.0 110.753 -176.647 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' MET . . . . . 0.404 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 48.7 ttp -65.09 109.13 2.05 Favored 'General case' 0 N--CA 1.426 -1.631 0 CA-C-O 121.227 0.537 . . . . 0.0 111.818 -176.311 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 89.95 2.36 75.04 Favored Glycine 0 N--CA 1.429 -1.777 0 CA-C-N 114.357 -1.292 . . . . 0.0 111.756 -178.037 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.501 ' HB3' HG22 ' A' ' 60' ' ' VAL . 4.8 t70 -77.28 152.27 34.68 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 -177.662 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.45 ' O ' ' HD2' ' A' ' 61' ' ' TYR . 20.7 pt20 -84.15 -24.32 30.27 Favored 'General case' 0 C--N 1.292 -1.895 0 CA-C-O 121.609 0.719 . . . . 0.0 109.809 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -61.13 -21.1 63.42 Favored 'General case' 0 CA--C 1.498 -1.039 0 CA-C-N 115.351 -0.84 . . . . 0.0 112.015 -179.163 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.59 HG11 ' HB3' ' A' ' 54' ' ' GLN . 28.8 m -119.47 2.39 7.18 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.073 0 CA-C-N 115.19 -0.914 . . . . 0.0 112.359 -173.708 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.45 ' HD2' ' O ' ' A' ' 58' ' ' GLN . 0.9 OUTLIER -65.3 114.63 16.19 Favored Pre-proline 0 C--N 1.314 -0.978 0 O-C-N 124.121 0.888 . . . . 0.0 110.504 -177.552 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -89.86 113.33 0.53 Allowed 'Trans proline' 0 N--CA 1.419 -2.871 0 C-N-CA 122.491 2.128 . . . . 0.0 109.688 177.052 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -70.64 -140.05 0.18 Allowed Glycine 0 C--N 1.281 -2.514 0 CA-C-N 114.923 -1.035 . . . . 0.0 113.163 177.094 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.402 ' HA ' ' O ' ' A' ' 104' ' ' TYR . 11.8 Cg_endo -56.16 145.24 77.28 Favored 'Trans proline' 0 C--O 1.252 1.205 0 C-N-CA 122.67 2.247 . . . . 0.0 112.739 -178.2 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 60.9 mt -72.63 117.09 15.67 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.98 -178.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.597 ' HB2' ' HG3' ' A' ' 107' ' ' MET . 17.0 t0 -116.33 104.53 11.57 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-O 121.896 0.855 . . . . 0.0 111.384 178.389 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.664 ' O ' HD23 ' A' ' 71' ' ' LEU . 42.9 m-80 -92.91 5.86 49.86 Favored 'General case' 0 C--N 1.284 -2.245 0 CA-C-N 114.899 -1.046 . . . . 0.0 111.04 -178.621 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 19.2 t -72.74 83.89 1.18 Allowed 'General case' 0 N--CA 1.445 -0.676 0 CA-C-O 122.523 1.154 . . . . 0.0 107.899 177.3 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 169.25 -20.74 0.08 OUTLIER Glycine 0 N--CA 1.42 -2.414 0 N-CA-C 108.45 -1.86 . . . . 0.0 108.45 -175.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.427 HD22 ' HB3' ' A' ' 89' ' ' TYR . 79.2 mt -88.41 -29.53 20.16 Favored 'General case' 0 CA--C 1.484 -1.568 0 N-CA-C 104.667 -2.345 . . . . 0.0 104.667 171.532 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.664 HD23 ' O ' ' A' ' 67' ' ' ASN . 2.2 mm? -75.88 156.79 33.99 Favored 'General case' 0 N--CA 1.38 -3.959 0 CA-C-N 110.781 -2.918 . . . . 0.0 107.084 173.114 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.457 ' HG3' ' O ' ' A' ' 78' ' ' SER . 38.0 mtpt -64.22 -176.95 0.24 Allowed 'General case' 0 C--N 1.292 -1.892 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 -174.621 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -62.82 -23.73 67.41 Favored 'General case' 0 CA--C 1.487 -1.444 0 N-CA-C 114.343 1.238 . . . . 0.0 114.343 -169.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -149.73 39.66 0.89 Allowed Glycine 0 N--CA 1.404 -3.464 0 C-N-CA 119.192 -1.48 . . . . 0.0 111.575 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -142.23 151.99 42.65 Favored 'General case' 0 CA--C 1.484 -1.558 0 CA-C-N 115.682 -0.259 . . . . 0.0 110.427 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -119.23 -1.86 10.77 Favored 'General case' 0 C--N 1.3 -1.554 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.71 177.247 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 -116.9 -14.17 10.67 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-O 121.732 0.777 . . . . 0.0 110.175 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.457 ' O ' ' HG3' ' A' ' 72' ' ' LYS . 20.2 m -108.15 119.71 40.27 Favored 'General case' 0 C--N 1.299 -1.629 0 CA-C-N 114.81 -1.086 . . . . 0.0 110.845 -175.276 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.575 HD11 HG21 ' A' ' 113' ' ' ILE . 3.0 mm? -81.58 148.8 28.93 Favored 'General case' 0 N--CA 1.437 -1.087 0 C-N-CA 123.914 0.886 . . . . 0.0 111.986 -179.75 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -63.68 151.9 40.59 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.557 176.452 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -75.1 -35.83 61.72 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-O 122.145 0.974 . . . . 0.0 108.653 -178.176 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 15.4 t-80 -88.07 12.8 12.58 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-N 114.486 -1.234 . . . . 0.0 112.795 -170.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.434 ' HB3' ' CE2' ' A' ' 89' ' ' TYR . 43.2 mt -57.23 141.63 45.88 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 114.263 1.208 . . . . 0.0 114.263 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.808 HG21 HD12 ' A' ' 87' ' ' LEU . 62.8 mt -137.14 166.49 25.37 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 N-CA-C 106.251 -1.759 . . . . 0.0 106.251 -178.519 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.579 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 17.7 t70 -62.55 -146.22 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.213 0 C-N-CA 125.582 1.553 . . . . 0.0 110.586 -178.097 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.712 ' HA ' ' O ' ' A' ' 89' ' ' TYR 0.271 0.0 OUTLIER -40.74 -18.19 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.662 0 N-CA-C 117.014 2.228 . . . . 0.0 117.014 -174.029 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.808 HD12 HG21 ' A' ' 84' ' ' ILE . 44.4 mt -61.02 -61.03 2.87 Favored 'General case' 0 C--N 1.281 -2.411 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.838 170.113 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -97.83 -41.19 8.16 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 -176.585 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' TYR . . . . . 0.712 ' O ' ' HA ' ' A' ' 86' ' ' GLU . 1.3 p90 -139.9 -169.15 2.66 Favored 'General case' 0 C--O 1.155 -3.892 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.571 -174.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.474 ' O ' ' HA ' ' A' ' 32' ' ' LEU . 10.3 mt -146.21 153.01 13.41 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.343 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 170.801 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.405 ' N ' HG22 ' A' ' 90' ' ' ILE . 81.7 mt -117.73 134.69 54.65 Favored 'General case' 0 N--CA 1.413 -2.302 0 O-C-N 124.2 0.938 . . . . 0.0 110.907 177.14 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.435 HD12 ' N ' ' A' ' 92' ' ' LEU . 1.8 mp -140.2 159.53 63.53 Favored Pre-proline 0 C--N 1.291 -1.971 0 N-CA-C 106.794 -1.558 . . . . 0.0 106.794 -177.516 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -63.46 168.75 10.8 Favored 'Trans proline' 0 C--O 1.256 1.389 0 C-N-CA 121.992 1.795 . . . . 0.0 110.251 175.811 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.435 ' HA ' ' CE1' ' A' ' 31' ' ' TYR . 33.0 m -42.8 -47.95 5.59 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 124.532 1.145 . . . . 0.0 110.799 172.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -66.21 -38.15 87.26 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-N 114.613 -1.176 . . . . 0.0 112.33 -175.731 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.471 ' O ' ' HG ' ' A' ' 100' ' ' LEU . . . -62.18 -51.3 57.64 Favored Glycine 0 N--CA 1.429 -1.815 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 -179.278 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.436 ' HB2' ' HB2' ' A' ' 31' ' ' TYR . 69.1 t-105 -57.54 -50.04 74.38 Favored 'General case' 0 N--CA 1.428 -1.566 0 CA-C-N 114.594 -0.803 . . . . 0.0 110.35 174.617 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -48.26 -45.22 34.28 Favored 'General case' 0 CA--C 1.489 -1.368 0 O-C-N 123.788 0.68 . . . . 0.0 111.621 176.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.419 ' HE3' HD11 ' A' ' 19' ' ' LEU . 60.5 mttm -66.4 -45.27 80.55 Favored 'General case' 0 N--CA 1.426 -1.639 0 CA-C-O 120.639 0.257 . . . . 0.0 110.625 -177.213 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 96' ' ' GLY . 64.9 mt -65.1 -34.23 77.92 Favored 'General case' 0 C--N 1.292 -1.934 0 CA-C-O 121.403 0.62 . . . . 0.0 111.289 -178.929 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.51 ' HA ' ' HA ' ' A' ' 105' ' ' THR . 8.8 t -78.84 -23.8 13.0 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.456 0 CA-C-O 121.771 0.796 . . . . 0.0 111.12 176.594 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 67.1 m -73.51 -37.98 65.5 Favored 'General case' 0 N--CA 1.418 -2.031 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 174.648 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' TRP . . . . . 0.59 ' CD1' ' HA ' ' A' ' 6' ' ' ALA . 44.8 m0 -84.34 -42.44 15.75 Favored 'General case' 0 N--CA 1.424 -1.758 0 CA-C-N 114.995 -1.002 . . . . 0.0 112.959 -174.28 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' TYR . . . . . 0.402 ' O ' ' HA ' ' A' ' 64' ' ' PRO . 73.1 m-85 -127.63 -5.28 5.84 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 111.817 0.303 . . . . 0.0 111.817 -174.418 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.51 ' HA ' ' HA ' ' A' ' 101' ' ' VAL 0.288 13.7 t 50.62 -174.11 0.02 OUTLIER 'General case' 0 C--O 1.247 0.927 0 C-N-CA 125.788 1.635 . . . . 0.0 113.979 -173.69 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.425 ' HG ' ' N ' ' A' ' 107' ' ' MET . 37.1 tp -107.13 149.85 27.21 Favored 'General case' 0 C--N 1.244 -3.996 0 CA-C-N 113.305 -1.77 . . . . 0.0 109.057 -177.419 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.597 ' HG3' ' HB2' ' A' ' 66' ' ' ASP . 80.3 mmm -59.38 154.37 16.99 Favored 'General case' 0 CA--C 1.492 -1.267 0 CA-C-O 122.131 0.967 . . . . 0.0 111.039 173.236 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -76.57 140.31 41.02 Favored 'General case' 0 N--CA 1.396 -3.165 0 CA-C-N 114.468 -1.242 . . . . 0.0 111.322 -176.131 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 88.84 -25.9 9.15 Favored Glycine 0 N--CA 1.412 -2.904 0 CA-C-N 114.743 -1.117 . . . . 0.0 113.667 175.674 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -92.01 172.19 8.61 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 119.681 -0.808 . . . . 0.0 109.355 -177.148 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -121.67 158.33 54.46 Favored Pre-proline 0 N--CA 1.432 -1.352 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -177.299 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' PRO . . . . . 0.409 ' HB3' ' CE2' ' A' ' 97' ' ' TRP . 22.9 Cg_exo -67.79 122.39 9.54 Favored 'Trans proline' 0 CA--C 1.448 -3.792 0 C-N-CA 122.358 2.039 . . . . 0.0 109.174 169.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.575 HG21 HD11 ' A' ' 79' ' ' LEU . 3.3 mp -82.79 109.33 16.55 Favored 'Isoleucine or valine' 1 N--CA 1.375 -4.208 0 CA-C-N 114.322 -1.308 . . . . 0.0 108.057 -178.637 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -102.13 137.98 39.69 Favored 'General case' 0 C--N 1.277 -2.574 0 CA-C-N 115.472 -0.786 . . . . 0.0 109.975 179.667 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.504 ' HB2' HD11 ' A' ' 32' ' ' LEU . 5.7 tpt180 -135.34 -178.71 5.23 Favored 'General case' 0 N--CA 1.402 -2.857 0 N-CA-C 103.841 -2.651 . . . . 0.0 103.841 178.269 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -137.03 179.27 6.48 Favored 'General case' 0 N--CA 1.402 -2.87 0 C-N-CA 118.217 -1.393 . . . . 0.0 113.27 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.639 HG12 ' HB2' ' A' ' 24' ' ' LEU . 7.3 m -60.4 -176.85 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.383 -3.793 0 CA-C-N 111.408 -2.633 . . . . 0.0 112.915 174.083 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 30.8 m -71.87 146.04 11.76 Favored 'Isoleucine or valine' 0 N--CA 1.386 -3.657 0 CA-C-N 114.894 -1.048 . . . . 0.0 109.783 175.572 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.402 ' H ' ' HG2' ' A' ' 119' ' ' GLU . 12.5 pt-20 -102.47 7.71 40.2 Favored 'General case' 0 C--N 1.273 -2.759 0 CA-C-N 114.258 -1.337 . . . . 0.0 109.409 -176.615 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.412 -2.332 0 CA-C-N 114.347 -1.297 . . . . 0.0 109.151 -178.053 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mpt? . . . . . 0 CA--C 1.501 -0.927 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -135.38 152.37 51.36 Favored 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 58.88 85.84 0.09 Allowed 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -101.51 60.56 0.59 Allowed Glycine 0 N--CA 1.434 -1.476 0 N-CA-C 109.358 -1.497 . . . . 0.0 109.358 175.714 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -80.78 88.07 1.34 Allowed Glycine 0 CA--C 1.485 -1.792 0 N-CA-C 110.694 -0.962 . . . . 0.0 110.694 -177.215 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.672 ' HA ' ' CD1' ' A' ' 103' ' ' TRP . . . -97.1 143.84 27.53 Favored 'General case' 0 N--CA 1.422 -1.874 0 CA-C-O 121.205 0.526 . . . . 0.0 112.416 -177.117 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.472 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . -72.74 175.9 6.04 Favored 'General case' 0 CA--C 1.502 -0.887 0 CA-C-N 114.281 -1.327 . . . . 0.0 109.613 175.153 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.682 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 13.8 t70 -69.14 145.46 53.32 Favored 'General case' 0 CA--C 1.467 -2.213 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 177.611 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -40.75 -51.53 3.07 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 126.083 1.753 . . . . 0.0 112.579 178.043 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -76.07 -31.55 58.83 Favored 'General case' 0 C--N 1.276 -2.587 0 CA-C-N 113.638 -1.619 . . . . 0.0 110.771 -176.065 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.502 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 3.7 m -65.14 -46.29 81.54 Favored 'General case' 0 N--CA 1.4 -2.94 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 177.271 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.682 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 53.7 mt-30 -54.66 -44.14 73.0 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-N 114.848 -1.069 . . . . 0.0 109.413 -179.081 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.474 ' CG ' ' HB ' ' A' ' 45' ' ' VAL . 3.2 mmp_? -70.32 -41.4 73.32 Favored 'General case' 0 N--CA 1.411 -2.387 0 N-CA-C 113.412 0.894 . . . . 0.0 113.412 -178.472 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.2 m -64.36 -46.3 84.02 Favored 'General case' 0 C--N 1.251 -3.683 0 CA-C-O 121.414 0.626 . . . . 0.0 110.484 -178.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.477 ' O ' ' HB ' ' A' ' 18' ' ' THR . 51.3 t0 -67.72 -46.83 71.07 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 114.659 -1.155 . . . . 0.0 109.671 -177.75 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.662 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 21.6 mm -71.94 -39.39 66.82 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.58 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.993 -177.449 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.487 ' O ' ' HG2' ' A' ' 21' ' ' LYS . . . -58.61 -34.8 71.54 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 -179.829 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.522 ' HA ' ' HE2' ' A' ' 21' ' ' LYS . 2.9 m -66.94 -42.07 85.92 Favored 'General case' 0 N--CA 1.4 -2.943 0 CA-C-N 113.975 -1.466 . . . . 0.0 111.905 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.456 HD11 ' HE3' ' A' ' 99' ' ' LYS . 82.0 mt -78.77 -12.67 60.03 Favored 'General case' 0 C--N 1.268 -2.962 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -175.644 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.662 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 20.6 mt -82.17 -31.48 30.42 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.098 -0.705 . . . . 0.0 109.098 176.264 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.522 ' HE2' ' HA ' ' A' ' 18' ' ' THR . 48.2 pttt -92.69 -25.93 18.02 Favored 'General case' 0 N--CA 1.425 -1.723 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.439 -174.101 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 31.8 m -67.73 137.67 55.66 Favored 'General case' 0 N--CA 1.398 -3.045 0 CA-C-O 122.336 1.065 . . . . 0.0 112.089 177.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.456 ' HA ' HD13 ' A' ' 24' ' ' LEU . 36.8 t -94.77 167.68 11.29 Favored 'General case' 0 N--CA 1.391 -3.421 0 CA-C-N 112.928 -1.942 . . . . 0.0 109.306 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.514 ' N ' HD13 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -105.19 177.95 4.7 Favored 'General case' 1 N--CA 1.377 -4.101 0 CA-C-N 112.834 -1.985 . . . . 0.0 114.301 -167.267 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.64 ' O ' HG21 ' A' ' 117' ' ' VAL . 25.1 mmt180 -134.13 143.24 47.83 Favored 'General case' 0 C--N 1.285 -2.215 0 CA-C-N 112.643 -2.071 . . . . 0.0 106.834 175.866 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 44.0 mtpt -67.9 95.19 0.51 Allowed 'General case' 0 C--N 1.306 -1.319 0 CA-C-O 121.808 0.813 . . . . 0.0 109.596 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 143.37 19.52 0.22 Allowed Glycine 0 N--CA 1.426 -1.971 0 CA-C-N 114.17 -1.377 . . . . 0.0 110.554 -174.355 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.403 ' HB2' ' CG2' ' A' ' 117' ' ' VAL . 37.1 m-20 -103.58 -179.63 4.0 Favored 'General case' 0 CA--C 1.499 -1.008 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 176.402 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 86.1 m -140.97 127.3 19.79 Favored 'General case' 0 N--CA 1.42 -1.958 0 N-CA-C 106.576 -1.638 . . . . 0.0 106.576 176.015 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.465 ' CZ2' HD12 ' A' ' 24' ' ' LEU . 42.2 m95 -112.84 119.4 37.88 Favored 'General case' 0 C--N 1.301 -1.502 0 CA-C-O 121.021 0.439 . . . . 0.0 109.988 -177.172 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.456 ' HB2' ' HB2' ' A' ' 97' ' ' TRP . 86.5 m-85 -94.36 148.67 21.99 Favored 'General case' 0 C--N 1.277 -2.545 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.594 -176.154 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.561 ' HA ' ' O ' ' A' ' 90' ' ' ILE . 6.2 mp -98.1 139.72 33.49 Favored 'General case' 0 CA--C 1.475 -1.932 0 O-C-N 124.042 0.839 . . . . 0.0 111.008 178.567 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.401 ' HA ' ' OD1' ' A' ' 67' ' ' ASN . 59.4 t -118.44 138.68 48.37 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.878 0 N-CA-C 105.52 -2.03 . . . . 0.0 105.52 172.343 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.51 ' OD1' ' HG2' ' A' ' 36' ' ' ARG . 19.5 t0 -63.8 128.7 36.98 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 106.86 -1.533 . . . . 0.0 106.86 171.777 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 83.0 p -68.15 -27.12 66.15 Favored 'General case' 0 C--O 1.193 -1.91 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 -170.69 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.51 ' HG2' ' OD1' ' A' ' 34' ' ' ASP . 19.1 mmt180 -64.59 -39.34 93.55 Favored 'General case' 0 N--CA 1.433 -1.322 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.329 -175.774 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.481 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 66.8 t90 -68.41 -47.27 67.72 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 178.019 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.455 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 39.3 t80 -60.72 -39.71 89.63 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.422 -179.831 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.516 ' HA ' ' HE3' ' A' ' 42' ' ' LYS . 93.1 mttt -66.36 -32.29 73.59 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 122.819 0.448 . . . . 0.0 111.98 176.795 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.481 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 4.9 tp-100 -68.94 -42.02 77.29 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 174.104 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.641 ' O ' HG22 ' A' ' 45' ' ' VAL . 52.9 t90 -64.45 -37.27 86.96 Favored 'General case' 0 N--CA 1.428 -1.574 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.685 177.165 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.516 ' HE3' ' HA ' ' A' ' 39' ' ' LYS . 7.2 mtmp? -51.37 -47.78 62.71 Favored 'General case' 0 C--N 1.369 1.424 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 175.222 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.47 ' HB3' ' HB2' ' A' ' 54' ' ' GLN . 63.3 mttm -55.03 -50.42 69.1 Favored 'General case' 0 CA--C 1.499 -1.009 0 O-C-N 124.178 0.924 . . . . 0.0 109.938 177.824 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.536 ' O ' ' HA ' ' A' ' 55' ' ' MET . 5.1 t80 -60.09 -38.99 84.55 Favored 'General case' 0 C--N 1.309 -1.152 0 CA-C-N 114.032 -1.44 . . . . 0.0 113.605 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.641 HG22 ' O ' ' A' ' 41' ' ' TRP . 0.2 OUTLIER -91.2 -30.04 4.8 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.519 0 N-CA-C 114.39 1.255 . . . . 0.0 114.39 -179.516 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.652 ' HA2' ' CB ' ' A' ' 52' ' ' LYS . . . 87.92 34.76 9.62 Favored Glycine 0 N--CA 1.4 -3.742 0 C-N-CA 120.229 -0.986 . . . . 0.0 112.69 -176.334 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.47 ' CD1' ' CZ ' ' A' ' 13' ' ' ARG . 89.9 t80 -60.7 -49.81 76.0 Favored 'General case' 0 CA--C 1.508 -0.672 0 CA-C-O 121.814 0.816 . . . . 0.0 110.257 177.502 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.525 ' HB3' ' HB3' ' A' ' 51' ' ' ASP . 1.5 t0 -81.94 -176.65 6.23 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 114.123 -1.399 . . . . 0.0 110.717 -168.257 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' SER . . . . . 0.416 ' O ' ' HE2' ' A' ' 52' ' ' LYS . 16.9 m -91.68 -42.96 9.88 Favored 'General case' 0 C--N 1.292 -1.927 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.625 -177.333 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.483 ' CE2' ' HB2' ' A' ' 51' ' ' ASP . 64.8 p-90 -101.29 -20.17 15.34 Favored 'General case' 0 N--CA 1.395 -3.187 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 -176.664 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.525 ' HB3' ' HB3' ' A' ' 48' ' ' ASP . 31.0 t70 -103.37 78.62 1.63 Allowed 'General case' 0 CA--C 1.459 -2.548 0 CA-C-N 114.07 -1.423 . . . . 0.0 109.057 -169.343 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.652 ' CB ' ' HA2' ' A' ' 46' ' ' GLY . 65.5 pttt -169.92 3.55 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.429 0 CA-C-N 113.632 -1.622 . . . . 0.0 114.829 -174.322 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -64.6 -9.59 20.46 Favored 'General case' 0 C--N 1.299 -1.598 0 CA-C-O 121.561 0.696 . . . . 0.0 110.898 175.647 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.47 ' HB2' ' HB3' ' A' ' 43' ' ' LYS . 9.6 mm-40 -106.62 19.32 20.66 Favored 'General case' 0 N--CA 1.416 -2.147 0 C-N-CA 124.344 1.058 . . . . 0.0 109.832 -176.319 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' MET . . . . . 0.536 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 48.8 ttm -58.69 109.17 0.75 Allowed 'General case' 0 N--CA 1.424 -1.768 0 CA-C-O 121.444 0.64 . . . . 0.0 111.335 -178.765 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.91 23.9 75.31 Favored Glycine 0 N--CA 1.439 -1.131 0 CA-C-N 115.177 -0.92 . . . . 0.0 112.195 -178.643 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -95.04 151.88 18.8 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-O 121.115 0.483 . . . . 0.0 110.786 -175.865 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -83.69 -21.33 32.4 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.103 -178.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -63.51 -18.86 64.25 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.03 -0.986 . . . . 0.0 111.918 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 12.7 m -115.24 -9.12 12.3 Favored 'Isoleucine or valine' 0 CA--C 1.443 -3.172 0 CA-C-O 118.327 -0.844 . . . . 0.0 112.834 -178.524 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 1.6 p90 -34.34 100.47 0.19 Allowed Pre-proline 0 CA--C 1.557 1.219 0 O-C-N 126.3 2.25 . . . . 0.0 114.181 -163.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -78.29 102.46 1.57 Allowed 'Trans proline' 0 N--CA 1.425 -2.543 0 C-N-CA 122.797 2.331 . . . . 0.0 109.777 174.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -82.01 -146.87 5.91 Favored Glycine 0 C--N 1.295 -1.715 0 CA-C-N 114.29 -1.323 . . . . 0.0 111.629 177.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.454 ' HA ' ' O ' ' A' ' 104' ' ' TYR . 86.8 Cg_exo -50.23 133.92 36.68 Favored 'Trans proline' 0 C--O 1.238 0.492 0 C-N-CA 123.763 2.975 . . . . 0.0 113.82 178.747 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.603 HD11 ' HB3' ' A' ' 100' ' ' LEU . 45.2 mt -68.53 115.12 6.25 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 CA-C-N 114.764 -1.107 . . . . 0.0 111.437 -176.07 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -110.82 121.24 44.85 Favored 'General case' 0 C--N 1.289 -2.033 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 173.241 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.401 ' OD1' ' HA ' ' A' ' 33' ' ' VAL . 38.5 m-80 -109.03 18.47 20.6 Favored 'General case' 0 C--N 1.306 -1.3 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.725 -176.833 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 10.0 t -68.8 -2.7 10.08 Favored 'General case' 0 CA--C 1.552 1.039 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -176.471 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -83.74 -19.88 60.81 Favored Glycine 0 N--CA 1.441 -1.011 0 N-CA-C 111.607 -0.597 . . . . 0.0 111.607 176.297 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 64.7 mt -91.09 -25.89 19.4 Favored 'General case' 0 CA--C 1.499 -1.018 0 CA-C-O 121.79 0.805 . . . . 0.0 109.699 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 50.1 mt -71.36 129.48 38.93 Favored 'General case' 0 N--CA 1.421 -1.876 0 CA-C-N 114.087 -1.415 . . . . 0.0 110.892 -173.018 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 73.2 tttt -66.48 156.25 35.33 Favored 'General case' 0 N--CA 1.402 -2.867 0 CA-C-N 114.483 -1.235 . . . . 0.0 109.824 -178.766 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -73.12 105.29 4.5 Favored 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 179.023 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 142.55 -54.59 0.6 Allowed Glycine 0 C--N 1.309 -0.945 0 N-CA-C 111.802 -0.519 . . . . 0.0 111.802 178.425 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -131.64 143.83 50.59 Favored 'General case' 0 CA--C 1.484 -1.574 0 CA-C-O 120.857 0.361 . . . . 0.0 110.785 178.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -83.57 3.12 33.94 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-O 121.88 0.848 . . . . 0.0 110.567 178.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 20.8 mm-40 -112.41 -3.21 14.53 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-O 122.414 1.102 . . . . 0.0 108.221 178.162 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 68.0 m -100.74 137.45 39.12 Favored 'General case' 0 C--N 1.284 -2.252 0 CA-C-N 113.481 -1.69 . . . . 0.0 109.586 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.576 HD21 HG21 ' A' ' 113' ' ' ILE . 96.6 mt -106.94 153.02 23.16 Favored 'General case' 0 C--N 1.296 -1.718 0 CA-C-O 120.953 0.406 . . . . 0.0 111.402 -178.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.417 ' HB2' ' HG ' ' A' ' 83' ' ' LEU . 67.9 mttm -65.14 153.09 41.89 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.28 175.069 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -77.0 -33.84 57.55 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 114.581 1.326 . . . . 0.0 114.581 -169.308 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 19.5 t-80 -98.35 11.76 37.02 Favored 'General case' 0 C--N 1.298 -1.658 0 CA-C-O 120.696 0.284 . . . . 0.0 111.726 -172.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.417 ' HG ' ' HB2' ' A' ' 80' ' ' LYS . 83.2 mt -66.36 118.63 10.29 Favored 'General case' 0 C--N 1.307 -1.259 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -176.693 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.563 HG21 HD12 ' A' ' 87' ' ' LEU . 44.8 mm -92.56 170.43 1.23 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 N-CA-C 106.674 -1.602 . . . . 0.0 106.674 175.398 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.654 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 22.4 t70 -60.62 -130.53 0.0 OUTLIER 'General case' 0 CA--C 1.577 2.011 0 C-N-CA 125.472 1.509 . . . . 0.0 112.403 -177.589 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.703 ' HA ' ' O ' ' A' ' 89' ' ' TYR . 9.6 pt-20 -47.51 -17.39 0.09 Allowed 'General case' 0 N--CA 1.5 2.075 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 -176.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.563 HD12 HG21 ' A' ' 84' ' ' ILE . 11.8 mt -67.65 -54.22 21.43 Favored 'General case' 0 C--N 1.29 -2.005 0 CA-C-N 115.201 -0.909 . . . . 0.0 110.394 176.201 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -101.48 -33.8 9.81 Favored 'General case' 0 CA--C 1.499 -0.989 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.136 -178.333 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' TYR . . . . . 0.703 ' O ' ' HA ' ' A' ' 86' ' ' GLU . 4.8 p90 -141.11 -160.61 1.1 Allowed 'General case' 0 C--O 1.183 -2.398 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 -179.188 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.561 ' O ' ' HA ' ' A' ' 32' ' ' LEU . 1.2 mm -141.19 145.43 24.98 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.879 0 N-CA-C 106.908 -1.515 . . . . 0.0 106.908 172.24 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.49 HD23 ' HA ' ' A' ' 91' ' ' LEU . 58.2 mt -116.93 123.9 48.09 Favored 'General case' 0 N--CA 1.42 -1.967 0 CA-C-O 121.784 0.802 . . . . 0.0 111.122 171.035 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.55 HD11 ' HB ' ' A' ' 90' ' ' ILE . 1.0 OUTLIER -137.07 155.38 76.15 Favored Pre-proline 0 C--N 1.289 -2.049 0 CA-C-N 114.171 -1.377 . . . . 0.0 108.526 -175.493 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -61.56 169.24 7.06 Favored 'Trans proline' 0 C--O 1.255 1.338 0 C-N-CA 123.213 2.609 . . . . 0.0 110.786 176.337 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 32.3 m -47.17 -43.28 21.04 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 123.96 0.788 . . . . 0.0 109.406 173.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.536 ' HB3' ' HE2' ' A' ' 99' ' ' LYS . 9.2 mm-40 -56.28 -51.26 68.81 Favored 'General case' 0 C--O 1.196 -1.73 0 C-N-CA 124.422 1.089 . . . . 0.0 111.079 178.266 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.561 ' O ' HD22 ' A' ' 100' ' ' LEU . . . -50.87 -62.11 5.56 Favored Glycine 0 CA--C 1.497 -1.085 0 O-C-N 124.322 1.014 . . . . 0.0 111.567 -177.6 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.456 ' HB2' ' HB2' ' A' ' 31' ' ' TYR . 68.5 t-105 -53.5 -50.79 64.65 Favored 'General case' 0 C--N 1.309 -1.152 0 C-N-CA 123.696 0.799 . . . . 0.0 110.905 177.69 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -52.2 -34.57 46.08 Favored 'General case' 0 C--O 1.207 -1.148 0 O-C-N 123.562 0.539 . . . . 0.0 112.118 177.058 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.536 ' HE2' ' HB3' ' A' ' 95' ' ' GLU . 50.8 mttm -75.01 -51.67 13.01 Favored 'General case' 0 N--CA 1.412 -2.358 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.603 ' HB3' HD11 ' A' ' 65' ' ' ILE . 0.7 OUTLIER -58.95 -39.79 82.71 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.379 0.609 . . . . 0.0 111.534 -179.041 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.433 ' O ' ' HA ' ' A' ' 105' ' ' THR . 20.5 t -73.51 -31.08 31.63 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.172 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.851 177.559 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 37.5 t -73.91 -35.09 64.6 Favored 'General case' 0 C--N 1.314 -0.972 0 O-C-N 121.535 -0.728 . . . . 0.0 109.036 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' TRP . . . . . 0.672 ' CD1' ' HA ' ' A' ' 6' ' ' ALA . 49.4 m0 -78.24 -50.2 12.33 Favored 'General case' 0 N--CA 1.421 -1.924 0 CA-C-N 114.773 -1.103 . . . . 0.0 112.031 -176.731 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' TYR . . . . . 0.454 ' O ' ' HA ' ' A' ' 64' ' ' PRO . 55.2 m-85 -128.9 10.16 5.92 Favored 'General case' 0 CA--C 1.505 -0.764 0 N-CA-C 114.498 1.296 . . . . 0.0 114.498 -172.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.433 ' HA ' ' O ' ' A' ' 101' ' ' VAL 0.274 7.2 p 56.33 174.63 0.04 OUTLIER 'General case' 0 N--CA 1.418 -2.038 0 N-CA-C 117.025 2.231 . . . . 0.0 117.025 179.164 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.496 ' HG ' ' N ' ' A' ' 107' ' ' MET . 28.6 tp -104.93 161.59 14.07 Favored 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 114.57 -1.196 . . . . 0.0 108.487 -179.12 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.496 ' N ' ' HG ' ' A' ' 106' ' ' LEU . 24.4 tpp -72.19 141.06 49.04 Favored 'General case' 0 N--CA 1.38 -3.967 0 CA-C-O 122.047 0.927 . . . . 0.0 109.241 173.26 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . 0.276 6.7 tp10 -74.99 125.87 29.81 Favored 'General case' 1 N--CA 1.346 -5.625 0 CA-C-N 113.504 -1.68 . . . . 0.0 110.181 -174.547 . . . . . . . . 3 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 104.22 -6.25 46.31 Favored Glycine 0 N--CA 1.412 -2.959 0 CA-C-N 114.589 -1.187 . . . . 0.0 112.661 177.508 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.443 HE21 ' HB3' ' A' ' 110' ' ' GLN . 2.3 pt20 -109.34 158.08 18.25 Favored 'General case' 0 CA--C 1.494 -1.207 0 C-N-CA 117.936 -1.505 . . . . 0.0 109.805 177.252 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -122.39 133.47 24.4 Favored Pre-proline 0 C--N 1.286 -2.187 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -177.027 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -41.66 133.59 3.73 Favored 'Trans proline' 0 CA--C 1.477 -2.372 0 C-N-CA 124.687 3.591 . . . . 0.0 114.671 -177.201 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.576 HG21 HD21 ' A' ' 79' ' ' LEU . 3.6 mp -96.34 108.74 21.71 Favored 'Isoleucine or valine' 0 N--CA 1.385 -3.709 0 CA-C-N 113.053 -1.885 . . . . 0.0 107.007 179.437 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -113.72 147.89 37.4 Favored 'General case' 0 C--N 1.283 -2.283 0 CA-C-O 122.072 0.939 . . . . 0.0 113.024 -176.749 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.506 ' HG2' HD11 ' A' ' 32' ' ' LEU . 3.0 mmp_? -127.02 177.62 6.52 Favored 'General case' 0 CA--C 1.476 -1.867 0 N-CA-C 105.537 -2.023 . . . . 0.0 105.537 174.002 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -134.22 166.75 22.07 Favored 'General case' 0 C--N 1.258 -3.39 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.64 HG21 ' O ' ' A' ' 25' ' ' ARG . 59.8 t -54.15 144.01 5.67 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.222 0 CA-C-O 122.493 1.139 . . . . 0.0 111.386 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 13.8 m -84.7 175.33 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.396 -3.166 0 CA-C-N 113.489 -1.687 . . . . 0.0 113.053 -172.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -62.6 -42.72 99.74 Favored 'General case' 0 N--CA 1.433 -1.322 0 CA-C-N 114.185 -1.371 . . . . 0.0 110.219 179.237 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 . . . . . 0 C--N 1.311 -1.08 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.039 -178.89 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.7 tmm? . . . . . 0 CA--C 1.508 -0.666 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -137.86 140.35 40.4 Favored 'General case' 0 N--CA 1.431 -1.388 0 CA-C-O 120.986 0.422 . . . . 0.0 110.54 -178.807 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.435 ' HB2' ' CE1' ' A' ' 104' ' ' TYR . 56.6 mm-40 -95.58 119.48 34.15 Favored 'General case' 0 C--N 1.303 -1.44 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.19 175.872 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -115.57 6.64 20.56 Favored Glycine 0 C--N 1.307 -1.081 0 N-CA-C 111.241 -0.743 . . . . 0.0 111.241 -179.308 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -85.74 -106.17 0.72 Allowed Glycine 0 N--CA 1.435 -1.414 0 N-CA-C 110.877 -0.889 . . . . 0.0 110.877 178.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 56.43 -158.3 0.25 Allowed 'General case' 0 C--O 1.245 0.865 0 C-N-CA 123.396 0.678 . . . . 0.0 111.84 176.634 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.454 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . -93.74 175.21 6.82 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 175.422 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.611 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 12.5 t70 -68.24 144.3 54.95 Favored 'General case' 0 C--N 1.291 -1.961 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 173.373 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.479 ' O ' ' HG3' ' A' ' 13' ' ' ARG . 3.1 mm? -43.63 -53.12 5.94 Favored 'General case' 0 C--N 1.298 -1.662 0 C-N-CA 125.906 1.682 . . . . 0.0 112.67 177.802 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -67.9 -34.49 76.73 Favored 'General case' 0 C--N 1.276 -2.604 0 CA-C-N 114.61 -1.177 . . . . 0.0 110.293 -177.596 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.467 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 2.9 m -66.44 -46.66 75.73 Favored 'General case' 0 N--CA 1.384 -3.747 0 CA-C-N 114.99 -1.005 . . . . 0.0 110.522 178.042 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.611 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 71.0 mt-30 -56.1 -53.82 52.46 Favored 'General case' 0 N--CA 1.444 -0.758 0 O-C-N 123.548 0.53 . . . . 0.0 110.577 -177.581 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.524 ' HG2' HG13 ' A' ' 45' ' ' VAL . 59.2 mtt180 -46.64 -58.57 3.7 Favored 'General case' 0 N--CA 1.487 1.381 0 CA-C-O 122.432 1.11 . . . . 0.0 109.798 177.208 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 54.7 m -66.89 -45.49 77.86 Favored 'General case' 0 C--N 1.295 -1.787 0 CA-C-N 113.068 -1.878 . . . . 0.0 113.306 -170.442 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -67.82 -32.38 72.89 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.51 -175.188 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.536 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 27.7 mm -82.5 -38.29 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.142 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.274 177.106 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.07 -34.95 72.55 Favored 'General case' 0 CA--C 1.501 -0.941 0 CA-C-O 122.027 0.917 . . . . 0.0 108.73 179.016 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.452 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 2.6 m -64.81 -33.88 77.04 Favored 'General case' 0 N--CA 1.401 -2.912 0 CA-C-N 113.656 -1.611 . . . . 0.0 111.299 177.792 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.611 ' HB3' ' CG ' ' A' ' 93' ' ' PRO . 89.7 mt -85.94 -12.97 49.12 Favored 'General case' 0 C--N 1.267 -3.003 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -176.454 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.536 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 11.6 mt -86.43 -21.63 26.99 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 176.954 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.452 ' HE3' ' HA ' ' A' ' 18' ' ' THR . 0.0 OUTLIER -97.75 -4.44 37.06 Favored 'General case' 0 N--CA 1.426 -1.649 0 CA-C-N 114.537 -1.21 . . . . 0.0 111.333 -174.649 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.52 ' OG1' ' HA ' ' A' ' 19' ' ' LEU . 52.8 m -54.59 134.5 46.72 Favored 'General case' 0 N--CA 1.398 -3.075 0 C-N-CA 126.291 1.836 . . . . 0.0 111.351 173.323 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 68.3 m -70.48 132.64 45.87 Favored 'General case' 0 N--CA 1.387 -3.592 0 CA-C-N 113.405 -1.725 . . . . 0.0 111.338 179.121 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.49 HD22 HG13 ' A' ' 117' ' ' VAL . 1.7 pp -110.68 159.43 17.6 Favored 'General case' 0 N--CA 1.411 -2.408 0 CA-C-N 115.353 -0.84 . . . . 0.0 112.592 179.021 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.694 ' O ' HG11 ' A' ' 117' ' ' VAL . 19.9 mmt180 -105.51 -144.68 0.38 Allowed 'General case' 0 C--N 1.271 -2.821 0 N-CA-C 103.727 -2.694 . . . . 0.0 103.727 177.684 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.401 ' HA ' ' HB ' ' A' ' 117' ' ' VAL . 17.6 ptpt -128.91 14.93 6.36 Favored 'General case' 0 C--N 1.283 -2.323 0 CA-C-O 122.108 0.956 . . . . 0.0 109.868 166.952 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -130.89 20.53 4.8 Favored Glycine 0 N--CA 1.429 -1.803 0 CA-C-N 114.149 -1.387 . . . . 0.0 112.474 -179.632 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 45.0 m-20 -91.03 169.61 10.73 Favored 'General case' 0 CA--C 1.492 -1.258 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 177.419 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.512 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 85.1 m -118.67 130.68 55.98 Favored 'General case' 0 N--CA 1.409 -2.512 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 175.72 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.437 ' CZ2' HD23 ' A' ' 24' ' ' LEU . 33.4 m95 -114.7 155.98 25.63 Favored 'General case' 0 C--N 1.284 -2.277 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 177.008 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.546 ' HB2' ' HB2' ' A' ' 97' ' ' TRP . 84.9 m-85 -111.25 129.83 55.85 Favored 'General case' 0 C--N 1.264 -3.152 0 CA-C-O 121.04 0.448 . . . . 0.0 110.055 -178.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.8 HD11 ' CG ' ' A' ' 89' ' ' TYR . 26.3 tp -86.84 138.96 31.14 Favored 'General case' 1 N--CA 1.376 -4.17 0 N-CA-C 114.374 1.249 . . . . 0.0 114.374 -174.841 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.511 HG12 ' O ' ' A' ' 34' ' ' ASP . 46.3 t -132.85 154.04 39.02 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.465 0 C-N-CA 126.498 1.919 . . . . 0.0 107.821 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.522 ' CA ' HD21 ' A' ' 70' ' ' LEU . 23.0 t70 -71.09 144.11 50.42 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 173.299 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.456 ' HA ' HG13 ' A' ' 90' ' ' ILE . 50.2 p -71.98 -35.65 69.57 Favored 'General case' 0 C--N 1.277 -2.578 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.337 -171.699 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 17.0 mmm180 -80.75 -26.53 37.25 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 120.356 -0.538 . . . . 0.0 109.705 -174.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.489 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 67.1 t90 -65.99 -46.89 76.4 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 107.622 -1.251 . . . . 0.0 107.622 177.348 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.507 ' CG ' HD12 ' A' ' 90' ' ' ILE . 33.8 t80 -65.89 -37.65 86.67 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.329 179.488 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.477 ' HA ' ' HD3' ' A' ' 42' ' ' LYS . 94.6 mttt -67.03 -29.76 69.66 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 176.169 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.489 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 5.5 tp-100 -66.78 -45.91 76.97 Favored 'General case' 0 N--CA 1.406 -2.67 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 173.007 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 67.4 t90 -59.83 -41.54 91.55 Favored 'General case' 0 C--O 1.213 -0.828 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.649 176.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.538 ' HG2' ' CD1' ' A' ' 47' ' ' PHE . 15.2 mtpp -56.73 -38.19 72.04 Favored 'General case' 0 N--CA 1.44 -0.947 0 C-N-CA 123.252 0.621 . . . . 0.0 112.298 -179.469 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 44.1 mttp -76.54 -37.95 55.84 Favored 'General case' 0 C--N 1.281 -2.391 0 CA-C-N 116.004 -0.543 . . . . 0.0 112.251 178.589 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.632 ' HB2' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -69.03 -35.57 76.76 Favored 'General case' 0 N--CA 1.412 -2.343 0 CA-C-N 114.857 -1.065 . . . . 0.0 109.59 -179.746 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.524 HG13 ' HG2' ' A' ' 13' ' ' ARG . 2.5 p -89.93 -22.28 6.46 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.654 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -177.223 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.481 ' HA2' ' CB ' ' A' ' 52' ' ' LYS . . . 87.67 28.84 23.01 Favored Glycine 0 N--CA 1.435 -1.41 0 C-N-CA 121.122 -0.561 . . . . 0.0 112.446 -174.269 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.538 ' CD1' ' HG2' ' A' ' 42' ' ' LYS . 32.7 t80 -77.44 -35.67 53.74 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 177.703 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.472 ' HB2' ' O ' ' A' ' 51' ' ' ASP . 26.6 m-20 -76.76 103.48 6.74 Favored 'General case' 0 CA--C 1.491 -1.315 0 N-CA-C 106.061 -1.829 . . . . 0.0 106.061 172.596 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 9.2 m -54.61 -32.18 58.36 Favored 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 -176.546 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 45.7 p90 -95.5 -9.32 32.82 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.26 -178.835 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.472 ' O ' ' HB2' ' A' ' 48' ' ' ASP . 17.5 t0 -139.94 83.85 1.94 Allowed 'General case' 0 CA--C 1.487 -1.447 0 CA-C-O 122.398 1.094 . . . . 0.0 109.27 -175.349 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.481 ' CB ' ' HA2' ' A' ' 46' ' ' GLY . 55.4 pttt -145.93 16.31 1.39 Allowed 'General case' 0 N--CA 1.409 -2.504 0 CA-C-N 113.819 -1.537 . . . . 0.0 111.226 -173.828 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 19.9 p90 -69.11 -7.53 36.96 Favored 'General case' 0 C--N 1.285 -2.212 0 CA-C-N 114.589 -1.187 . . . . 0.0 111.115 173.117 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -102.75 12.0 36.85 Favored 'General case' 0 N--CA 1.41 -2.454 0 CA-C-N 114.591 -1.186 . . . . 0.0 109.679 -178.683 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' MET . . . . . 0.574 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 33.1 ttm -60.49 113.84 2.64 Favored 'General case' 0 N--CA 1.422 -1.835 0 CA-C-O 121.698 0.761 . . . . 0.0 111.898 -179.594 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 74.25 18.87 79.87 Favored Glycine 0 N--CA 1.431 -1.69 0 CA-C-N 114.736 -1.12 . . . . 0.0 111.558 -178.478 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.6 ' HB3' HG22 ' A' ' 60' ' ' VAL . 4.5 t0 -88.13 145.45 25.92 Favored 'General case' 0 CA--C 1.493 -1.215 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 -177.773 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.442 ' O ' ' HD1' ' A' ' 61' ' ' TYR . 11.5 pt20 -83.8 -8.66 59.18 Favored 'General case' 0 C--N 1.283 -2.313 0 CA-C-O 122.329 1.062 . . . . 0.0 110.535 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -72.99 -20.42 61.02 Favored 'General case' 0 C--N 1.288 -2.092 0 CA-C-N 114.419 -1.264 . . . . 0.0 111.003 173.539 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.632 HG23 ' HB2' ' A' ' 44' ' ' TYR . 35.4 m -128.1 7.9 3.07 Favored 'Isoleucine or valine' 0 CA--C 1.478 -1.805 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.375 -175.229 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.456 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 2.8 p90 -63.8 115.73 21.11 Favored Pre-proline 0 C--N 1.299 -1.593 0 O-C-N 124.098 0.874 . . . . 0.0 109.39 179.492 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' A' ' 61' ' ' TYR . 9.3 Cg_endo -87.19 111.86 0.87 Allowed 'Trans proline' 0 N--CA 1.417 -2.972 0 C-N-CA 122.37 2.046 . . . . 0.0 109.562 178.721 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -67.98 -147.19 0.14 Allowed Glycine 0 C--N 1.287 -2.162 0 CA-C-N 114.94 -1.027 . . . . 0.0 112.69 176.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -57.76 136.49 75.77 Favored 'Trans proline' 0 C--O 1.249 1.065 0 C-N-CA 122.101 1.868 . . . . 0.0 112.315 -177.151 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.482 HG12 ' CZ2' ' A' ' 37' ' ' TRP . 61.1 mt -62.79 110.17 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.074 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.912 -177.652 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -102.85 118.65 37.3 Favored 'General case' 0 C--N 1.299 -1.617 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.719 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -94.87 17.88 12.9 Favored 'General case' 0 C--N 1.296 -1.721 0 CA-C-N 115.71 -0.677 . . . . 0.0 112.615 179.544 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 19.4 m -79.67 24.57 0.37 Allowed 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 -176.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.445 ' H ' HD22 ' A' ' 70' ' ' LEU . . . -111.94 -21.7 6.24 Favored Glycine 0 CA--C 1.496 -1.104 0 N-CA-C 108.702 -1.759 . . . . 0.0 108.702 175.483 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.645 HD12 ' HB3' ' A' ' 89' ' ' TYR . 0.2 OUTLIER -102.72 -42.36 5.91 Favored 'General case' 0 N--CA 1.423 -1.791 0 CA-C-N 113.006 -1.597 . . . . 0.0 108.376 -173.45 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.55 HD13 ' HA ' ' A' ' 76' ' ' ALA . 91.2 mt -65.91 150.54 48.46 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-N 113.926 -1.488 . . . . 0.0 109.229 174.37 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -74.64 -167.87 0.62 Allowed 'General case' 0 C--N 1.296 -1.758 0 CA-C-O 122.049 0.928 . . . . 0.0 111.471 -176.24 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -95.97 97.96 10.02 Favored 'General case' 0 C--N 1.287 -2.112 0 CA-C-N 114.963 -1.017 . . . . 0.0 108.402 -177.692 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 127.01 -70.66 0.5 Allowed Glycine 0 N--CA 1.438 -1.167 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.246 179.04 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -85.11 128.84 34.81 Favored 'General case' 0 CA--C 1.495 -1.161 0 CA-C-O 120.761 0.315 . . . . 0.0 111.651 -179.519 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.55 ' HA ' HD13 ' A' ' 71' ' ' LEU . . . -90.92 13.97 15.08 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 122.079 0.942 . . . . 0.0 110.301 179.578 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 20.1 mm-40 -120.45 5.91 10.64 Favored 'General case' 0 C--N 1.282 -2.339 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 53.9 m -119.39 124.29 46.22 Favored 'General case' 0 C--N 1.281 -2.408 0 CA-C-N 114.381 -1.282 . . . . 0.0 112.771 -173.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.411 HD21 HG21 ' A' ' 113' ' ' ILE . 82.6 mt -92.05 150.09 21.16 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.438 178.011 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.404 ' HB2' ' HG ' ' A' ' 83' ' ' LEU . 99.8 mttt -71.02 151.84 44.18 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.148 178.091 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -78.03 -23.54 48.16 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.798 -177.638 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 31.7 m170 -88.32 4.77 44.88 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -175.813 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.438 ' HB3' ' CE2' ' A' ' 89' ' ' TYR . 98.1 mt -65.71 133.38 50.94 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 114.497 1.295 . . . . 0.0 114.497 -173.79 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.736 HG21 HD12 ' A' ' 87' ' ' LEU . 43.0 mm -115.13 -178.91 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.086 0 N-CA-C 104.977 -2.231 . . . . 0.0 104.977 172.016 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.576 ' H ' HG22 ' A' ' 84' ' ' ILE . 21.7 t70 -71.54 -134.53 0.01 OUTLIER 'General case' 0 CA--C 1.57 1.724 0 CA-C-O 117.515 -1.231 . . . . 0.0 110.564 -178.074 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.674 ' HA ' ' O ' ' A' ' 89' ' ' TYR . 3.0 pp20? -45.53 -19.41 0.05 OUTLIER 'General case' 0 N--CA 1.51 2.543 0 N-CA-C 116.117 1.895 . . . . 0.0 116.117 -174.699 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.736 HD12 HG21 ' A' ' 84' ' ' ILE . 23.4 mt -59.76 -50.44 73.84 Favored 'General case' 0 C--N 1.287 -2.138 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.467 172.64 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -101.53 -50.01 3.86 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-N 114.753 -1.112 . . . . 0.0 111.342 -178.42 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' TYR . . . . . 0.8 ' CG ' HD11 ' A' ' 32' ' ' LEU . 0.5 OUTLIER -141.16 -175.7 4.42 Favored 'General case' 0 C--O 1.163 -3.472 0 C-N-CA 122.885 0.474 . . . . 0.0 110.968 -175.04 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.516 ' O ' HD12 ' A' ' 32' ' ' LEU . 7.1 mt -142.24 145.79 23.31 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.499 0 CA-C-N 118.943 0.792 . . . . 0.0 109.49 173.098 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.455 HD23 ' HA ' ' A' ' 91' ' ' LEU . 62.7 mt -109.72 133.58 52.96 Favored 'General case' 0 N--CA 1.405 -2.715 0 CA-C-N 114.662 -1.154 . . . . 0.0 111.841 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.402 HD22 ' N ' ' A' ' 92' ' ' LEU . 1.4 mm? -123.98 151.16 64.62 Favored Pre-proline 0 C--N 1.282 -2.332 0 CA-C-N 113.557 -1.656 . . . . 0.0 106.947 -177.57 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.611 ' CG ' ' HB3' ' A' ' 19' ' ' LEU . 11.1 Cg_endo -65.9 169.18 13.74 Favored 'Trans proline' 0 N--CA 1.443 -1.478 0 C-N-CA 121.937 1.758 . . . . 0.0 109.122 170.149 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 21.7 m -43.98 -48.35 8.66 Favored 'General case' 0 C--N 1.315 -0.917 0 O-C-N 123.518 0.512 . . . . 0.0 111.467 174.571 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -71.74 -34.69 69.73 Favored 'General case' 0 CA--C 1.491 -1.292 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.273 -176.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.547 ' O ' HD22 ' A' ' 100' ' ' LEU . . . -56.87 -62.26 6.56 Favored Glycine 0 N--CA 1.42 -2.389 0 N-CA-C 109.979 -1.248 . . . . 0.0 109.979 178.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.546 ' HB2' ' HB2' ' A' ' 31' ' ' TYR . 59.0 t-105 -50.75 -51.52 49.38 Favored 'General case' 0 N--CA 1.434 -1.227 0 C-N-CA 124.869 1.268 . . . . 0.0 110.215 176.184 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -49.15 -37.49 22.32 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 177.121 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 60.0 mttm -72.38 -51.67 19.43 Favored 'General case' 0 N--CA 1.416 -2.158 0 CA-C-O 119.434 -0.317 . . . . 0.0 110.386 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.547 HD22 ' O ' ' A' ' 96' ' ' GLY . 0.8 OUTLIER -56.94 -39.41 74.47 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.36 0.6 . . . . 0.0 111.504 179.09 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.484 ' O ' ' HA ' ' A' ' 105' ' ' THR . 53.7 t -72.26 -30.78 36.69 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.838 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.78 177.708 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 6.5 t -82.27 -24.96 34.47 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 121.07 -1.019 . . . . 0.0 108.889 -177.704 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' TRP . . . . . . . . . . . . . 47.2 m0 -83.64 -45.86 12.98 Favored 'General case' 0 N--CA 1.425 -1.683 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.598 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' TYR . . . . . 0.435 ' CE1' ' HB2' ' A' ' 3' ' ' GLU . 29.0 m-85 -131.42 7.64 4.56 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -175.671 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.484 ' HA ' ' O ' ' A' ' 101' ' ' VAL 0.304 35.2 p 57.77 168.37 0.04 OUTLIER 'General case' 0 N--CA 1.416 -2.139 0 N-CA-C 117.666 2.469 . . . . 0.0 117.666 -179.849 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -91.87 153.8 19.29 Favored 'General case' 0 C--N 1.291 -1.955 0 N-CA-C 105.781 -1.933 . . . . 0.0 105.781 -179.624 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 32.2 tpp -73.69 152.21 40.51 Favored 'General case' 0 N--CA 1.381 -3.913 0 CA-C-O 122.357 1.075 . . . . 0.0 110.887 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -63.6 135.31 56.7 Favored 'General case' 0 N--CA 1.395 -3.219 0 CA-C-N 112.979 -1.919 . . . . 0.0 110.006 179.258 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 80.25 5.77 89.55 Favored Glycine 0 N--CA 1.408 -3.203 0 CA-C-N 114.406 -1.27 . . . . 0.0 113.011 178.339 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -111.45 168.49 9.49 Favored 'General case' 0 CA--C 1.482 -1.64 0 CA-C-N 117.799 0.8 . . . . 0.0 110.975 177.392 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' GLU . . . . . 0.454 ' O ' HD12 ' A' ' 113' ' ' ILE . 7.5 mt-10 -142.87 144.4 29.31 Favored Pre-proline 0 C--N 1.276 -2.624 0 N-CA-C 106.511 -1.663 . . . . 0.0 106.511 -177.077 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_exo -58.58 122.76 12.19 Favored 'Trans proline' 0 CA--C 1.462 -3.101 0 C-N-CA 122.788 2.325 . . . . 0.0 112.773 -177.547 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.454 HD12 ' O ' ' A' ' 111' ' ' GLU . 3.2 mp -82.77 107.31 14.45 Favored 'Isoleucine or valine' 0 N--CA 1.383 -3.823 0 CA-C-N 113.248 -1.797 . . . . 0.0 107.052 175.586 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.512 ' HB1' ' CG2' ' A' ' 29' ' ' THR . . . -92.46 124.95 36.87 Favored 'General case' 0 C--N 1.274 -2.7 0 CA-C-O 121.599 0.714 . . . . 0.0 109.44 177.454 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -127.78 124.06 36.75 Favored 'General case' 0 N--CA 1.401 -2.885 0 N-CA-C 105.403 -2.073 . . . . 0.0 105.403 -176.071 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -68.52 174.14 4.41 Favored 'General case' 0 C--N 1.29 -2.008 0 CA-C-O 121.651 0.738 . . . . 0.0 112.097 -177.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.694 HG11 ' O ' ' A' ' 25' ' ' ARG . 35.1 t -67.11 149.35 11.64 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.314 0 N-CA-C 105.633 -1.988 . . . . 0.0 105.633 169.853 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 27.0 m -66.21 145.36 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.401 -2.88 0 CA-C-O 121.45 0.643 . . . . 0.0 110.637 -178.003 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -96.2 3.44 53.16 Favored 'General case' 0 C--N 1.279 -2.462 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.041 -175.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.426 -1.662 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 177.322 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.437 ' SD ' ' HA3' ' A' ' 4' ' ' GLY . 52.0 ttm . . . . . 0 CA--C 1.508 -0.656 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -85.77 98.99 11.05 Favored 'General case' 0 N--CA 1.437 -1.12 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 176.795 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 70.25 107.0 0.06 Allowed 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 126.037 1.735 . . . . 0.0 111.672 -177.411 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.437 ' HA3' ' SD ' ' A' ' 1' ' ' MET . . . -150.53 37.53 0.9 Allowed Glycine 0 N--CA 1.434 -1.476 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.378 178.243 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 100.53 -117.91 6.02 Favored Glycine 0 N--CA 1.444 -0.784 0 C-N-CA 120.564 -0.827 . . . . 0.0 111.627 178.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.445 ' HA ' ' CD1' ' A' ' 103' ' ' TRP . . . -150.68 171.87 16.46 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-O 121.091 0.472 . . . . 0.0 111.025 179.096 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.473 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . -83.89 176.98 8.51 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.031 -178.89 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.609 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 16.5 t70 -72.84 146.67 46.08 Favored 'General case' 0 CA--C 1.481 -1.695 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 176.609 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -47.88 -48.74 31.23 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 124.65 1.18 . . . . 0.0 112.095 176.736 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -66.65 -37.58 85.11 Favored 'General case' 0 C--N 1.282 -2.341 0 CA-C-N 113.126 -1.852 . . . . 0.0 109.924 -178.799 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.473 ' CG2' ' HB1' ' A' ' 7' ' ' ALA . 3.4 m -65.37 -56.73 10.97 Favored 'General case' 0 N--CA 1.387 -3.576 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.548 177.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.609 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 76.5 mt-30 -44.55 -61.34 1.58 Allowed 'General case' 0 CA--C 1.508 -0.671 0 C-N-CA 125.035 1.334 . . . . 0.0 113.193 -173.664 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.488 ' HB3' HG21 ' A' ' 45' ' ' VAL . 0.0 OUTLIER -66.4 -35.34 80.07 Favored 'General case' 0 N--CA 1.432 -1.352 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 -174.6 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 33.1 t -77.75 -38.98 45.72 Favored 'General case' 0 C--N 1.28 -2.45 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.776 -178.835 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -65.62 -39.36 91.4 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 -177.084 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.604 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 34.8 mm -75.27 -39.64 42.54 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.383 0 CA-C-N 114.955 -1.02 . . . . 0.0 110.475 177.218 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.18 -33.66 72.52 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-O 121.531 0.681 . . . . 0.0 109.568 -178.598 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.57 ' HA ' ' HE2' ' A' ' 21' ' ' LYS . 1.0 OUTLIER -67.15 -31.33 71.68 Favored 'General case' 0 N--CA 1.407 -2.605 0 CA-C-N 114.25 -1.341 . . . . 0.0 112.153 178.791 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.486 ' HB3' ' HG2' ' A' ' 93' ' ' PRO . 71.3 mt -85.94 -16.97 36.7 Favored 'General case' 0 C--N 1.276 -2.59 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -177.705 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 11.0 mt -86.24 -24.42 26.03 Favored 'General case' 0 CA--C 1.502 -0.888 0 CA-C-O 121.231 0.539 . . . . 0.0 110.42 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.57 ' HE2' ' HA ' ' A' ' 18' ' ' THR . 39.6 pttt -86.74 -16.67 35.67 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.907 -171.57 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.4 m -55.33 137.56 47.45 Favored 'General case' 0 N--CA 1.402 -2.871 0 C-N-CA 125.662 1.585 . . . . 0.0 111.67 173.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.4 m -78.43 168.13 20.26 Favored 'General case' 0 N--CA 1.399 -2.994 0 CA-C-N 114.033 -1.44 . . . . 0.0 108.69 174.197 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.494 HD23 ' CZ2' ' A' ' 30' ' ' TRP 0.303 72.6 mt -74.69 138.47 42.84 Favored 'General case' 0 N--CA 1.397 -3.1 0 N-CA-C 116.321 1.971 . . . . 0.0 116.321 -173.812 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.497 ' HB2' ' HB2' ' A' ' 28' ' ' ASP . 7.4 mmm180 -81.54 -178.37 6.92 Favored 'General case' 0 C--N 1.29 -1.982 0 CA-C-N 111.288 -2.687 . . . . 0.0 107.746 -177.321 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 21.6 pttp -117.3 118.88 33.47 Favored 'General case' 0 C--N 1.292 -1.894 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 176.733 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 58.98 45.12 95.65 Favored Glycine 0 C--O 1.238 0.381 0 CA-C-O 121.479 0.488 . . . . 0.0 111.906 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.497 ' HB2' ' HB2' ' A' ' 25' ' ' ARG . 2.0 t0 -107.32 175.33 5.53 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 -177.81 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 31.2 m -119.19 123.41 44.29 Favored 'General case' 0 C--N 1.277 -2.581 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 179.694 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.494 ' CZ2' HD23 ' A' ' 24' ' ' LEU . 60.0 m95 -107.06 145.23 32.63 Favored 'General case' 0 C--N 1.279 -2.457 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 177.348 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.545 ' HB2' ' HB2' ' A' ' 97' ' ' TRP . 76.0 m-85 -109.01 127.58 54.21 Favored 'General case' 0 C--N 1.267 -3.01 0 CA-C-O 121.17 0.51 . . . . 0.0 110.933 -177.424 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.661 HD11 ' CD1' ' A' ' 89' ' ' TYR . 23.7 tp -88.33 134.06 33.91 Favored 'General case' 0 N--CA 1.379 -3.993 0 CA-C-N 114.095 -1.411 . . . . 0.0 114.514 -174.842 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 41.5 t -126.88 143.55 39.96 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.728 0 C-N-CA 126.64 1.976 . . . . 0.0 108.753 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.512 ' OD1' ' HB2' ' A' ' 36' ' ' ARG . 11.0 t70 -67.82 123.37 20.38 Favored 'General case' 0 C--N 1.307 -1.257 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 172.825 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 10.7 t -66.99 -24.26 66.02 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 120.664 0.269 . . . . 0.0 110.955 -172.551 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.512 ' HB2' ' OD1' ' A' ' 34' ' ' ASP . 13.9 mtm-85 -74.31 -25.23 59.45 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.241 0.544 . . . . 0.0 110.633 -177.159 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 69.5 t90 -72.74 -44.82 61.17 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 107.253 -1.388 . . . . 0.0 107.253 172.527 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.499 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 34.9 t80 -60.84 -37.84 83.42 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 114.773 -1.103 . . . . 0.0 110.798 178.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.441 ' HA ' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -52.65 -44.14 65.95 Favored 'General case' 0 C--N 1.352 0.714 0 N-CA-C 112.141 0.423 . . . . 0.0 112.141 174.026 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -64.54 -43.39 94.13 Favored 'General case' 0 N--CA 1.423 -1.782 0 C-N-CA 123.127 0.571 . . . . 0.0 109.756 179.093 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.629 ' O ' HG22 ' A' ' 45' ' ' VAL . 74.0 t90 -60.3 -40.29 90.0 Favored 'General case' 0 N--CA 1.429 -1.513 0 CA-C-N 114.642 -1.163 . . . . 0.0 111.009 179.229 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.499 ' HG3' ' O ' ' A' ' 38' ' ' PHE . 34.0 mtmt -52.08 -46.28 65.14 Favored 'General case' 0 CA--C 1.494 -1.193 0 O-C-N 123.357 0.411 . . . . 0.0 111.955 -179.678 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 61.6 mttm -69.33 -45.22 69.98 Favored 'General case' 0 CA--C 1.479 -1.75 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.572 -176.442 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.567 ' HB2' HG23 ' A' ' 60' ' ' VAL . 0.2 OUTLIER -57.96 -33.01 68.4 Favored 'General case' 0 N--CA 1.424 -1.748 0 CA-C-N 115.287 -0.869 . . . . 0.0 112.782 179.487 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.629 HG22 ' O ' ' A' ' 41' ' ' TRP . 3.7 m -95.16 -17.21 7.12 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.194 0 N-CA-C 113.692 0.997 . . . . 0.0 113.692 178.734 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 78.32 39.47 22.55 Favored Glycine 0 C--N 1.302 -1.325 0 N-CA-C 109.139 -1.584 . . . . 0.0 109.139 -172.652 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.459 ' HB2' HG23 ' A' ' 45' ' ' VAL . 46.6 t80 -74.25 -37.6 63.73 Favored 'General case' 0 N--CA 1.439 -1.012 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 178.27 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -74.23 120.92 20.46 Favored 'General case' 0 CA--C 1.49 -1.343 0 N-CA-C 106.677 -1.601 . . . . 0.0 106.677 174.313 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' SER . . . . . 0.534 ' HA ' ' HE3' ' A' ' 52' ' ' LYS . 30.5 m -58.65 -31.47 68.18 Favored 'General case' 0 C--N 1.298 -1.66 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -177.956 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 46.2 p90 -86.21 -15.0 42.26 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.354 -178.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 45.6 t0 -122.8 95.27 4.56 Favored 'General case' 0 CA--C 1.487 -1.476 0 CA-C-O 122.489 1.138 . . . . 0.0 110.871 -174.763 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.534 ' HE3' ' HA ' ' A' ' 49' ' ' SER . 34.3 mmtp -119.51 5.35 11.1 Favored 'General case' 0 C--N 1.284 -2.244 0 CA-C-N 113.624 -1.625 . . . . 0.0 108.621 -178.119 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 84.1 m-85 -78.54 -27.04 45.85 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.787 -174.775 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.566 ' HB3' HG11 ' A' ' 60' ' ' VAL . 9.5 mm100 -92.81 -3.11 55.27 Favored 'General case' 0 N--CA 1.404 -2.726 0 CA-C-N 114.746 -1.116 . . . . 0.0 110.683 -176.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' MET . . . . . 0.461 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 45.4 ttm -60.73 115.46 3.67 Favored 'General case' 0 N--CA 1.423 -1.808 0 C-N-CA 122.535 0.334 . . . . 0.0 110.535 -178.315 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.86 16.99 80.29 Favored Glycine 0 N--CA 1.439 -1.143 0 CA-C-N 115.437 -0.802 . . . . 0.0 112.251 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.584 ' HB3' HG22 ' A' ' 60' ' ' VAL . 5.9 t0 -91.74 147.5 22.94 Favored 'General case' 0 CA--C 1.502 -0.876 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 -178.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -83.5 -18.69 37.6 Favored 'General case' 0 C--N 1.295 -1.804 0 CA-C-O 121.909 0.861 . . . . 0.0 108.893 178.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 76.9 m-20 -62.34 -21.32 65.21 Favored 'General case' 0 CA--C 1.504 -0.815 0 CA-C-N 114.654 -1.157 . . . . 0.0 111.705 178.011 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.584 HG22 ' HB3' ' A' ' 57' ' ' ASP . 27.3 m -122.98 15.0 5.41 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.629 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.944 -176.631 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.443 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 1.1 p90 -55.89 120.14 31.14 Favored Pre-proline 0 C--N 1.292 -1.905 0 O-C-N 124.477 1.11 . . . . 0.0 111.439 -178.575 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.482 ' HG3' ' HA ' ' A' ' 41' ' ' TRP . 6.9 Cg_endo -91.4 115.03 0.41 Allowed 'Trans proline' 0 N--CA 1.421 -2.759 0 C-N-CA 122.909 2.406 . . . . 0.0 110.377 172.46 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -75.82 -153.85 4.58 Favored Glycine 0 C--N 1.282 -2.447 0 CA-C-N 114.256 -1.338 . . . . 0.0 111.964 175.042 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.412 ' HA ' ' O ' ' A' ' 104' ' ' TYR . 31.9 Cg_exo -57.35 144.08 92.23 Favored 'Trans proline' 0 C--O 1.244 0.786 0 C-N-CA 122.883 2.389 . . . . 0.0 111.88 -179.121 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 68.4 mt -64.69 118.55 7.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.22 -176.801 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.428 ' HB2' ' HG3' ' A' ' 107' ' ' MET . 12.6 t70 -106.85 109.46 21.37 Favored 'General case' 0 N--CA 1.436 -1.157 0 O-C-N 123.461 0.475 . . . . 0.0 110.086 179.226 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.44 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 94.9 m-20 -100.9 11.65 39.17 Favored 'General case' 0 C--N 1.297 -1.686 0 CA-C-N 115.384 -0.825 . . . . 0.0 111.644 179.403 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 75.7 m -69.9 -16.86 63.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.019 0.438 . . . . 0.0 111.089 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -72.75 -19.0 79.1 Favored Glycine 0 N--CA 1.44 -1.074 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 175.022 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.467 ' CD2' ' HB3' ' A' ' 89' ' ' TYR . 74.6 mt -96.06 -35.07 11.5 Favored 'General case' 0 CA--C 1.496 -1.134 0 CA-C-O 121.262 0.553 . . . . 0.0 109.623 177.483 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.604 HD13 ' HA ' ' A' ' 76' ' ' ALA . 87.8 mt -69.81 150.02 47.3 Favored 'General case' 0 N--CA 1.425 -1.691 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.198 -178.821 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 47.1 mtpt -69.9 -169.32 0.25 Allowed 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 -173.404 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -54.37 -46.53 73.03 Favored 'General case' 0 CA--C 1.496 -1.125 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 -171.305 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -144.59 14.22 2.01 Favored Glycine 0 C--N 1.269 -3.148 0 C-N-CA 119.45 -1.357 . . . . 0.0 113.431 -178.453 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -120.67 119.07 31.77 Favored 'General case' 0 CA--C 1.49 -1.346 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 178.463 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.604 ' HA ' HD13 ' A' ' 71' ' ' LEU . . . -92.37 19.42 7.15 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-O 121.957 0.884 . . . . 0.0 110.207 -179.255 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 16.9 mm-40 -123.42 4.07 9.07 Favored 'General case' 0 C--N 1.281 -2.38 0 N-CA-C 107.598 -1.26 . . . . 0.0 107.598 -178.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.485 ' O ' ' HA ' ' A' ' 71' ' ' LEU . 70.7 m -132.6 131.93 41.97 Favored 'General case' 0 C--N 1.286 -2.153 0 CA-C-N 114.296 -1.32 . . . . 0.0 112.368 -173.166 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 36.7 tp -94.97 143.92 26.09 Favored 'General case' 0 N--CA 1.389 -3.524 0 C-N-CA 125.438 1.495 . . . . 0.0 108.706 -178.511 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 56.1 mtmt -66.94 158.15 31.52 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 -178.044 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -69.81 -49.91 48.09 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 114.336 1.236 . . . . 0.0 114.336 -167.567 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 29.9 m170 -93.48 12.01 26.57 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.439 0.903 . . . . 0.0 113.439 -170.541 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 16.3 mt -72.69 130.38 40.39 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-O 121.701 0.762 . . . . 0.0 112.555 -174.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.658 HG21 HD12 ' A' ' 87' ' ' LEU . 50.7 mm -101.19 175.13 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.935 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 -179.566 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.566 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 6.3 p-10 -64.59 -141.15 0.0 OUTLIER 'General case' 0 C--O 1.2 -1.538 0 C-N-CA 124.915 1.286 . . . . 0.0 112.158 -177.601 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.547 ' HA ' ' O ' ' A' ' 89' ' ' TYR . 0.0 OUTLIER -40.88 -19.9 0.01 OUTLIER 'General case' 0 N--CA 1.516 2.868 0 N-CA-C 115.804 1.779 . . . . 0.0 115.804 -173.865 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.658 HD12 HG21 ' A' ' 84' ' ' ILE . 15.2 mt -58.4 -53.52 57.41 Favored 'General case' 0 C--N 1.29 -2.017 0 C-N-CA 124.056 0.943 . . . . 0.0 109.88 171.618 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -107.11 -40.57 5.39 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.266 0.555 . . . . 0.0 111.138 -178.449 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' TYR . . . . . 0.661 ' CD1' HD11 ' A' ' 32' ' ' LEU . 1.8 p90 -140.31 174.13 10.82 Favored 'General case' 0 C--O 1.159 -3.671 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.832 -175.091 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.506 ' O ' HD12 ' A' ' 32' ' ' LEU . 6.0 mt -138.81 143.83 31.13 Favored 'Isoleucine or valine' 0 CA--C 1.481 -1.709 0 O-C-N 120.899 -1.126 . . . . 0.0 110.811 178.054 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.48 ' HA ' HD23 ' A' ' 91' ' ' LEU . 57.5 mt -106.24 128.11 53.72 Favored 'General case' 0 N--CA 1.404 -2.738 0 CA-C-N 114.183 -1.371 . . . . 0.0 111.838 177.938 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -115.92 149.75 43.8 Favored Pre-proline 0 C--N 1.272 -2.799 0 CA-C-N 113.064 -1.88 . . . . 0.0 106.236 -178.048 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.486 ' HG2' ' HB3' ' A' ' 19' ' ' LEU . 38.8 Cg_exo -65.36 169.13 12.97 Favored 'Trans proline' 0 N--CA 1.439 -1.679 0 N-CA-C 107.782 -1.661 . . . . 0.0 107.782 168.071 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 10.4 m -40.38 -47.96 2.64 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 123.928 0.767 . . . . 0.0 110.633 172.531 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -68.06 -39.8 82.93 Favored 'General case' 0 C--O 1.208 -1.129 0 CA-C-N 114.637 -1.165 . . . . 0.0 112.047 -175.054 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.475 ' O ' ' HG ' ' A' ' 100' ' ' LEU . . . -61.19 -52.89 48.96 Favored Glycine 0 N--CA 1.433 -1.518 0 N-CA-C 110.619 -0.992 . . . . 0.0 110.619 -178.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.545 ' HB2' ' HB2' ' A' ' 31' ' ' TYR . 69.5 t-105 -55.66 -53.33 57.81 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 123.596 0.758 . . . . 0.0 110.273 174.872 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 97.0 m-20 -46.86 -41.47 15.77 Favored 'General case' 0 C--O 1.199 -1.591 0 C-N-CA 123.349 0.66 . . . . 0.0 111.688 176.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.436 ' HB2' ' O ' ' A' ' 96' ' ' GLY . 41.6 mttm -64.46 -53.88 41.34 Favored 'General case' 0 CA--C 1.477 -1.862 0 CA-C-O 121.553 0.692 . . . . 0.0 109.989 -178.736 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 96' ' ' GLY . 77.8 mt -65.53 -33.42 75.88 Favored 'General case' 0 C--N 1.265 -3.096 0 CA-C-N 114.502 -1.226 . . . . 0.0 112.694 -176.148 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.428 ' O ' ' HA ' ' A' ' 105' ' ' THR . 48.1 t -79.64 -25.81 12.37 Favored 'Isoleucine or valine' 0 N--CA 1.4 -2.956 0 CA-C-O 121.494 0.664 . . . . 0.0 110.864 176.04 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 62.4 m -76.2 -38.04 57.01 Favored 'General case' 0 N--CA 1.419 -1.998 0 O-C-N 121.189 -0.944 . . . . 0.0 109.621 175.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' TRP . . . . . 0.445 ' CD1' ' HA ' ' A' ' 6' ' ' ALA . 28.8 m0 -82.17 -44.13 16.82 Favored 'General case' 0 N--CA 1.435 -1.215 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.424 -177.295 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' TYR . . . . . 0.412 ' O ' ' HA ' ' A' ' 64' ' ' PRO . 36.7 m-85 -119.95 -12.12 9.2 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -172.431 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.428 ' HA ' ' O ' ' A' ' 101' ' ' VAL 0.333 11.7 t 53.63 -174.44 0.03 OUTLIER 'General case' 0 C--O 1.24 0.604 0 C-N-CA 126.501 1.92 . . . . 0.0 114.009 -172.9 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -105.32 148.33 27.16 Favored 'General case' 0 C--N 1.248 -3.848 0 CA-C-N 113.425 -1.716 . . . . 0.0 109.212 -171.694 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.428 ' HG3' ' HB2' ' A' ' 66' ' ' ASP . 68.4 mmm -73.13 156.92 38.16 Favored 'General case' 0 CA--C 1.504 -0.822 0 CA-C-O 120.926 0.393 . . . . 0.0 111.503 175.619 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -61.17 148.37 40.99 Favored 'General case' 0 C--N 1.31 -1.12 0 C-N-CA 124.55 1.14 . . . . 0.0 112.011 -179.765 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 78.49 -23.89 2.77 Favored Glycine 0 N--CA 1.432 -1.588 0 CA-C-N 114.535 -1.212 . . . . 0.0 113.551 175.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -85.37 159.39 20.01 Favored 'General case' 0 N--CA 1.426 -1.661 0 CA-C-O 121.672 0.748 . . . . 0.0 111.175 -176.421 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -134.98 156.03 78.73 Favored Pre-proline 0 C--N 1.273 -2.743 0 N-CA-C 106.303 -1.74 . . . . 0.0 106.303 175.673 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -58.36 122.44 11.68 Favored 'Trans proline' 0 CA--C 1.469 -2.726 0 C-N-CA 122.431 2.088 . . . . 0.0 111.159 176.071 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.53 ' HB ' ' HB3' ' A' ' 32' ' ' LEU . 63.0 mt -84.42 106.63 14.8 Favored 'Isoleucine or valine' 0 N--CA 1.381 -3.879 0 CA-C-N 113.028 -1.896 . . . . 0.0 106.933 179.085 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -94.74 125.76 39.61 Favored 'General case' 0 C--N 1.27 -2.883 0 CA-C-O 121.725 0.774 . . . . 0.0 110.377 -179.451 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 10.1 tpt180 -125.72 115.05 19.47 Favored 'General case' 0 N--CA 1.4 -2.952 0 N-CA-C 105.31 -2.107 . . . . 0.0 105.31 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -73.53 166.19 23.69 Favored 'General case' 0 C--N 1.274 -2.683 0 C-N-CA 120.37 -0.532 . . . . 0.0 111.103 -179.457 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 87.3 t -50.44 144.88 1.74 Allowed 'Isoleucine or valine' 0 C--O 1.242 0.677 0 O-C-N 124.0 0.813 . . . . 0.0 109.595 178.758 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 30.4 m -42.37 138.79 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.413 -2.314 0 C-N-CA 126.699 2.0 . . . . 0.0 116.027 -170.412 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -62.85 -26.95 69.01 Favored 'General case' 0 C--N 1.293 -1.872 0 CA-C-N 112.281 -2.236 . . . . 0.0 110.707 178.055 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 . . . . . 0 C--N 1.298 -1.635 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.124 -178.509 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 mpt? . . . . . 0 N--CA 1.473 0.691 0 CA-C-O 121.214 0.53 . . . . 0.0 110.53 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -149.61 31.96 0.72 Allowed 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -176.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -62.07 107.83 0.94 Allowed 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 114.308 -1.315 . . . . 0.0 112.104 -174.773 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -147.65 6.53 1.04 Allowed Glycine 0 N--CA 1.44 -1.07 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.169 178.267 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -152.37 59.52 0.41 Allowed Glycine 0 CA--C 1.482 -1.977 0 N-CA-C 110.844 -0.902 . . . . 0.0 110.844 -179.347 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.566 ' HA ' ' CD1' ' A' ' 103' ' ' TRP . . . -122.38 144.78 48.81 Favored 'General case' 0 N--CA 1.419 -1.989 0 CA-C-O 121.692 0.758 . . . . 0.0 112.471 -179.631 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.491 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . -73.13 166.53 22.94 Favored 'General case' 0 C--N 1.305 -1.344 0 CA-C-N 114.024 -1.444 . . . . 0.0 110.806 178.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.693 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 25.0 t70 -70.58 146.27 50.21 Favored 'General case' 0 CA--C 1.465 -2.299 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 174.545 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.496 ' O ' ' HG2' ' A' ' 13' ' ' ARG . 28.5 mt -53.79 -43.88 69.67 Favored 'General case' 0 CA--C 1.487 -1.454 0 CA-C-N 119.085 0.857 . . . . 0.0 111.166 -177.756 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -68.24 -24.19 64.88 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 114.897 -1.047 . . . . 0.0 110.094 -176.281 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.583 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 5.1 m -78.79 -50.77 10.75 Favored 'General case' 0 N--CA 1.38 -3.931 0 CA-C-N 114.498 -1.228 . . . . 0.0 109.462 175.092 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.693 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 52.0 mt-30 -49.16 -61.12 2.25 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.966 0.906 . . . . 0.0 112.298 -175.42 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.496 ' HG2' ' O ' ' A' ' 9' ' ' LEU . 1.6 ptm180 -49.05 -43.43 40.79 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-O 121.701 0.763 . . . . 0.0 112.356 177.619 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.4 m -75.32 -34.6 61.25 Favored 'General case' 0 C--N 1.278 -2.534 0 CA-C-N 114.549 -1.205 . . . . 0.0 112.493 -176.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.5 t0 -77.08 -36.74 55.55 Favored 'General case' 0 C--N 1.3 -1.582 0 C-N-CA 123.786 0.834 . . . . 0.0 109.628 -177.01 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.61 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 27.3 mm -73.12 -33.05 41.13 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.244 0 C-N-CA 123.235 0.614 . . . . 0.0 110.468 177.056 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.34 -36.46 71.19 Favored 'General case' 0 CA--C 1.502 -0.89 0 O-C-N 123.855 0.722 . . . . 0.0 109.092 -178.019 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.549 ' O ' ' HG3' ' A' ' 21' ' ' LYS . 24.7 m -54.15 -57.12 12.32 Favored 'General case' 0 N--CA 1.405 -2.708 0 C-N-CA 125.757 1.623 . . . . 0.0 111.096 177.663 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.518 ' HB3' ' HD2' ' A' ' 93' ' ' PRO . 2.7 mm? -66.81 -18.05 65.19 Favored 'General case' 1 N--CA 1.377 -4.099 0 N-CA-C 114.63 1.345 . . . . 0.0 114.63 -178.213 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.61 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 10.0 mt -84.43 -26.08 28.53 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-O 121.64 0.733 . . . . 0.0 109.442 178.593 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.549 ' HG3' ' O ' ' A' ' 18' ' ' THR . 0.0 OUTLIER -91.86 -7.57 48.95 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-N 114.667 -1.152 . . . . 0.0 110.822 -173.628 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 51.9 m -71.25 139.07 49.91 Favored 'General case' 0 N--CA 1.394 -3.275 0 CA-C-N 113.354 -1.748 . . . . 0.0 111.138 177.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 73.7 m -87.3 132.22 34.0 Favored 'General case' 0 N--CA 1.389 -3.501 0 CA-C-N 113.777 -1.556 . . . . 0.0 109.61 176.69 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.659 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP . 0.6 OUTLIER -80.21 160.09 25.73 Favored 'General case' 0 C--N 1.296 -1.756 0 N-CA-C 114.21 1.189 . . . . 0.0 114.21 -176.969 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.433 ' O ' HG21 ' A' ' 117' ' ' VAL . 0.0 OUTLIER -101.74 144.08 30.88 Favored 'General case' 0 C--N 1.295 -1.802 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 177.348 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -54.51 -22.2 12.24 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 116.649 2.092 . . . . 0.0 116.649 -169.178 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -134.7 33.53 2.47 Favored Glycine 0 C--N 1.293 -1.808 0 N-CA-C 110.409 -1.076 . . . . 0.0 110.409 -179.599 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.421 ' HB2' ' HB2' ' A' ' 25' ' ' ARG . 2.5 t70 -85.54 -177.17 6.36 Favored 'General case' 0 C--N 1.315 -0.933 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.285 -178.212 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.515 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 85.6 m -129.04 121.67 28.39 Favored 'General case' 0 N--CA 1.438 -1.061 0 CA-C-O 121.375 0.607 . . . . 0.0 110.249 -177.768 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.659 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 15.2 m95 -113.31 148.97 34.62 Favored 'General case' 0 N--CA 1.424 -1.767 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.35 -179.043 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.405 ' HB2' ' HB2' ' A' ' 97' ' ' TRP . 86.7 m-85 -106.68 142.68 35.94 Favored 'General case' 0 C--N 1.292 -1.922 0 C-N-CA 123.07 0.548 . . . . 0.0 111.385 -175.689 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.633 HD13 HG22 ' A' ' 113' ' ' ILE . 6.2 mp -93.17 133.18 36.62 Favored 'General case' 0 CA--C 1.496 -1.096 0 CA-C-O 122.184 0.992 . . . . 0.0 113.606 -177.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.439 HG12 ' O ' ' A' ' 34' ' ' ASP . 53.4 t -117.06 142.45 30.89 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.484 0 N-CA-C 104.845 -2.28 . . . . 0.0 104.845 174.046 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.439 ' O ' HG12 ' A' ' 33' ' ' VAL . 4.5 t0 -67.28 127.7 33.65 Favored 'General case' 0 C--N 1.288 -2.078 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 172.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 6.5 t -66.46 -30.16 70.44 Favored 'General case' 0 N--CA 1.423 -1.789 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 -174.694 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 47.1 mtp85 -71.52 -29.78 65.17 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.149 -176.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.445 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 70.6 t90 -69.6 -46.96 65.09 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 173.824 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.492 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 28.9 t80 -61.53 -41.88 97.99 Favored 'General case' 0 C--O 1.212 -0.886 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.075 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.495 ' HA ' ' HE3' ' A' ' 42' ' ' LYS . 0.1 OUTLIER -55.5 -41.2 72.75 Favored 'General case' 0 N--CA 1.439 -1.004 0 O-C-N 122.007 -0.433 . . . . 0.0 111.855 175.091 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.445 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 21.5 tp60 -65.45 -42.38 92.4 Favored 'General case' 0 N--CA 1.423 -1.81 0 C-N-CA 123.495 0.718 . . . . 0.0 109.698 176.45 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 65.2 t90 -61.1 -39.98 92.01 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.592 177.442 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.495 ' HE3' ' HA ' ' A' ' 39' ' ' LYS . 8.3 mtmp? -56.99 -42.81 80.93 Favored 'General case' 0 CA--C 1.495 -1.17 0 CA-C-N 117.948 0.34 . . . . 0.0 110.991 -179.691 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.514 ' HB3' ' HB2' ' A' ' 54' ' ' GLN . 93.5 mttt -58.63 -52.14 66.95 Favored 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 124.175 0.922 . . . . 0.0 109.283 178.37 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.528 ' HB2' HG23 ' A' ' 60' ' ' VAL . 0.4 OUTLIER -65.55 -41.13 93.34 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-N 114.175 -1.375 . . . . 0.0 112.482 -172.48 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.423 ' CG1' ' HB2' ' A' ' 47' ' ' PHE . 3.7 p -90.47 -12.72 9.44 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.721 0 CA-C-N 116.313 -0.403 . . . . 0.0 112.026 -175.678 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.776 ' HA2' ' HB2' ' A' ' 52' ' ' LYS . . . 64.23 45.32 93.89 Favored Glycine 0 N--CA 1.4 -3.72 0 C-N-CA 121.183 -0.532 . . . . 0.0 112.689 -171.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.423 ' HB2' ' CG1' ' A' ' 45' ' ' VAL . 94.5 t80 -66.44 -52.94 41.11 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 123.607 0.763 . . . . 0.0 112.002 -178.254 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.468 ' OD1' ' HB3' ' A' ' 42' ' ' LYS . 16.5 p-10 -99.08 99.64 10.68 Favored 'General case' 0 C--N 1.289 -2.051 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.923 -176.074 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 8.9 m -49.8 -29.73 8.41 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 125.547 1.539 . . . . 0.0 114.158 -176.006 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.432 ' CE2' ' HB2' ' A' ' 48' ' ' ASP . 49.1 p90 -72.56 -11.66 60.74 Favored 'General case' 0 C--N 1.322 -0.589 0 O-C-N 122.044 -0.41 . . . . 0.0 111.428 179.377 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.437 ' O ' ' HD2' ' A' ' 52' ' ' LYS . 20.1 t70 -129.26 -94.34 0.42 Allowed 'General case' 0 C--N 1.304 -1.387 0 CA-C-O 118.508 -0.758 . . . . 0.0 109.769 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.776 ' HB2' ' HA2' ' A' ' 46' ' ' GLY . 0.0 OUTLIER 42.8 29.11 0.15 Allowed 'General case' 0 CA--C 1.554 1.12 0 N-CA-C 116.392 1.997 . . . . 0.0 116.392 172.087 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.422 ' HD1' ' H ' ' A' ' 53' ' ' TYR . 1.6 p90 -63.82 -5.08 3.77 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 115.407 1.632 . . . . 0.0 115.407 -173.343 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.514 ' HB2' ' HB3' ' A' ' 43' ' ' LYS . 10.5 mm-40 -128.1 23.86 6.03 Favored 'General case' 0 C--N 1.285 -2.213 0 C-N-CA 124.015 0.926 . . . . 0.0 110.651 -171.321 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 50.4 ttm -57.0 108.26 0.49 Allowed 'General case' 0 N--CA 1.437 -1.098 0 C-N-CA 124.052 0.941 . . . . 0.0 110.784 -179.278 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.27 16.84 73.14 Favored Glycine 0 N--CA 1.434 -1.464 0 CA-C-N 115.855 -0.611 . . . . 0.0 112.299 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.552 ' HB3' HG22 ' A' ' 60' ' ' VAL . 7.6 t0 -86.97 148.56 25.27 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 178.405 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.464 ' O ' ' HD1' ' A' ' 61' ' ' TYR . 28.6 pt20 -85.19 -23.26 28.41 Favored 'General case' 0 C--N 1.292 -1.931 0 CA-C-O 121.493 0.663 . . . . 0.0 111.287 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 -62.04 -18.16 59.73 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-O 121.93 0.871 . . . . 0.0 111.699 -179.309 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.552 HG22 ' HB3' ' A' ' 57' ' ' ASP . 29.3 m -116.64 8.22 7.22 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.098 0 CA-C-N 115.028 -0.987 . . . . 0.0 112.225 -173.154 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.464 ' HD1' ' O ' ' A' ' 58' ' ' GLN . 2.8 p90 -60.37 116.85 19.62 Favored Pre-proline 0 C--N 1.308 -1.215 0 O-C-N 124.215 0.947 . . . . 0.0 110.681 -179.484 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 61' ' ' TYR . 7.7 Cg_endo -89.94 110.48 0.43 Allowed 'Trans proline' 0 N--CA 1.42 -2.818 0 C-N-CA 122.695 2.264 . . . . 0.0 109.39 175.411 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -69.66 -146.79 0.26 Allowed Glycine 0 C--N 1.291 -1.935 0 CA-C-N 115.03 -0.986 . . . . 0.0 112.879 177.307 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.637 ' HA ' ' O ' ' A' ' 104' ' ' TYR . 32.8 Cg_exo -55.34 134.47 64.06 Favored 'Trans proline' 0 C--O 1.247 0.94 0 C-N-CA 122.778 2.319 . . . . 0.0 112.2 -177.167 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.447 HD11 ' HB3' ' A' ' 100' ' ' LEU . 78.9 mt -62.29 125.14 18.12 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.039 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.433 -178.216 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.474 ' HB3' ' SD ' ' A' ' 107' ' ' MET . 7.1 p-10 -108.38 122.37 46.86 Favored 'General case' 0 N--CA 1.407 -2.602 0 CA-C-O 122.247 1.022 . . . . 0.0 109.222 177.797 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.567 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 93.8 m-20 -100.52 9.65 42.26 Favored 'General case' 0 C--N 1.279 -2.47 0 N-CA-C 107.189 -1.412 . . . . 0.0 107.189 171.182 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 6.0 m -57.28 -34.25 68.47 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 124.965 1.306 . . . . 0.0 111.12 -178.73 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -77.91 -13.01 83.86 Favored Glycine 0 N--CA 1.438 -1.171 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.272 178.53 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 36.6 mt -100.03 -14.77 18.49 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 179.446 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.567 ' HG ' ' O ' ' A' ' 67' ' ' ASN . 99.6 mt -80.43 139.19 36.58 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.863 -178.426 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -80.24 179.81 7.47 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.581 175.235 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -96.97 88.65 4.58 Favored 'General case' 0 C--N 1.288 -2.068 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -174.23 -56.23 0.05 OUTLIER Glycine 0 N--CA 1.426 -1.992 0 N-CA-C 111.015 -0.834 . . . . 0.0 111.015 -178.571 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.492 ' OD2' ' HG2' ' A' ' 77' ' ' GLN . 4.5 t70 -141.72 -169.63 2.94 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 107.139 -1.43 . . . . 0.0 107.139 177.331 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.464 ' HA ' HD13 ' A' ' 71' ' ' LEU . . . -110.2 11.83 23.52 Favored 'General case' 0 C--N 1.295 -1.793 0 CA-C-O 121.898 0.856 . . . . 0.0 109.254 177.858 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.492 ' HG2' ' OD2' ' A' ' 75' ' ' ASP . 56.8 mm-40 -118.66 -2.63 10.93 Favored 'General case' 0 C--N 1.299 -1.61 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 179.531 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 24.2 p -90.87 116.89 29.04 Favored 'General case' 0 N--CA 1.424 -1.764 0 CA-C-N 113.854 -1.521 . . . . 0.0 109.729 -177.594 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 19.1 tp -98.29 138.86 34.93 Favored 'General case' 0 N--CA 1.39 -3.444 0 C-N-CA 124.371 1.068 . . . . 0.0 110.068 -176.281 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.465 ' CB ' HD13 ' A' ' 83' ' ' LEU . 68.3 mttm -61.31 139.09 58.23 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.556 0.693 . . . . 0.0 111.26 177.593 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -89.28 -19.51 25.25 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-N 114.722 -1.126 . . . . 0.0 113.918 -168.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 28.5 m170 -86.28 -10.98 53.47 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -175.66 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.465 HD13 ' CB ' ' A' ' 80' ' ' LYS . 8.2 mp -76.77 139.2 40.32 Favored 'General case' 0 C--N 1.295 -1.768 0 N-CA-C 114.948 1.462 . . . . 0.0 114.948 -172.297 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.615 HG21 HD12 ' A' ' 87' ' ' LEU . 58.0 mt -101.05 178.06 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.426 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 176.339 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.719 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 12.2 t70 -64.87 -130.72 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.557 0 C-N-CA 124.372 1.069 . . . . 0.0 110.186 -177.295 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.42 ' HA ' ' O ' ' A' ' 89' ' ' TYR . 6.8 tp10 -38.43 -24.08 0.01 OUTLIER 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 127.585 2.354 . . . . 0.0 114.792 -179.192 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.615 HD12 HG21 ' A' ' 84' ' ' ILE . 18.6 mt -66.43 -47.5 73.03 Favored 'General case' 0 C--N 1.284 -2.28 0 C-N-CA 123.33 0.652 . . . . 0.0 110.821 177.159 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -113.63 -34.28 5.58 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.41 -175.794 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' TYR . . . . . 0.719 ' CE1' ' HA ' ' A' ' 85' ' ' ASP . 3.7 p90 -142.41 -163.87 1.7 Allowed 'General case' 0 C--O 1.187 -2.227 0 N-CA-C 106.315 -1.735 . . . . 0.0 106.315 -179.433 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.564 ' O ' ' HA ' ' A' ' 32' ' ' LEU . 4.7 mt -147.68 148.2 16.6 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.235 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 171.918 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.541 HD21 ' CD1' ' A' ' 32' ' ' LEU . 26.6 mt -109.81 126.2 53.54 Favored 'General case' 0 N--CA 1.397 -3.113 0 O-C-N 124.532 1.145 . . . . 0.0 111.476 175.329 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.411 HD23 HG23 ' A' ' 33' ' ' VAL . 1.6 mm? -118.86 149.51 46.74 Favored Pre-proline 0 C--N 1.306 -1.317 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.686 -177.86 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.518 ' HD2' ' HB3' ' A' ' 19' ' ' LEU . 50.0 Cg_exo -61.71 168.67 8.14 Favored 'Trans proline' 0 C--O 1.257 1.465 0 C-N-CA 122.051 1.834 . . . . 0.0 108.51 164.626 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 19.5 m -46.79 -41.01 14.74 Favored 'General case' 0 C--N 1.306 -1.321 0 O-C-N 123.607 0.567 . . . . 0.0 111.05 174.58 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 5.8 mp0 -61.96 -52.7 62.95 Favored 'General case' 0 CA--C 1.5 -0.95 0 C-N-CA 124.538 1.135 . . . . 0.0 111.046 -178.544 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.478 ' O ' ' HG ' ' A' ' 100' ' ' LEU . . . -56.07 -54.28 36.6 Favored Glycine 0 N--CA 1.429 -1.795 0 O-C-N 124.015 0.822 . . . . 0.0 111.848 -176.456 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.405 ' HB2' ' HB2' ' A' ' 31' ' ' TYR . 70.9 t-105 -55.65 -51.09 68.38 Favored 'General case' 0 N--CA 1.425 -1.724 0 C-N-CA 123.007 0.523 . . . . 0.0 111.312 176.148 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 -52.37 -34.97 50.21 Favored 'General case' 0 CA--C 1.485 -1.533 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 177.071 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.447 ' HB2' ' O ' ' A' ' 96' ' ' GLY . 54.2 mttm -67.01 -52.11 46.51 Favored 'General case' 0 CA--C 1.468 -2.21 0 CA-C-O 121.375 0.607 . . . . 0.0 110.419 178.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 96' ' ' GLY . 69.1 mt -65.99 -35.92 81.89 Favored 'General case' 0 C--N 1.261 -3.25 0 CA-C-N 114.752 -1.113 . . . . 0.0 111.945 -175.683 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.497 ' HA ' ' HA ' ' A' ' 105' ' ' THR . 18.6 t -77.59 -25.41 14.8 Favored 'Isoleucine or valine' 0 N--CA 1.399 -2.995 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.723 174.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 38.2 t -74.46 -38.22 63.02 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 176.637 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' TRP . . . . . 0.566 ' CD1' ' HA ' ' A' ' 6' ' ' ALA . 36.7 m0 -77.85 -54.56 6.18 Favored 'General case' 0 N--CA 1.422 -1.834 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.201 -176.022 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' TYR . . . . . 0.637 ' O ' ' HA ' ' A' ' 64' ' ' PRO . 30.9 m-85 -127.88 13.21 6.82 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 114.255 1.206 . . . . 0.0 114.255 -175.505 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' A' ' 101' ' ' VAL 0.252 10.0 t 47.28 -170.05 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 126.256 1.822 . . . . 0.0 115.473 178.755 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 52.6 tp -115.39 142.15 47.08 Favored 'General case' 0 C--N 1.26 -3.309 0 CA-C-N 113.29 -1.777 . . . . 0.0 109.006 -175.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.474 ' SD ' ' HB3' ' A' ' 66' ' ' ASP . 72.9 mtp -63.18 156.37 25.44 Favored 'General case' 0 CA--C 1.508 -0.656 0 CA-C-O 122.155 0.979 . . . . 0.0 113.621 178.6 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -71.53 147.66 47.5 Favored 'General case' 0 N--CA 1.413 -2.32 0 CA-C-N 113.967 -1.469 . . . . 0.0 111.533 178.563 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 94.76 -24.48 27.93 Favored Glycine 0 N--CA 1.418 -2.545 0 CA-C-N 114.926 -1.034 . . . . 0.0 113.504 175.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -113.65 169.86 8.67 Favored 'General case' 0 N--CA 1.421 -1.914 0 CA-C-O 120.698 0.285 . . . . 0.0 110.501 -177.217 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 65.8 mm-40 -137.1 155.57 76.01 Favored Pre-proline 0 C--N 1.301 -1.503 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 -177.598 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_exo -56.62 124.57 16.57 Favored 'Trans proline' 0 CA--C 1.463 -3.047 0 C-N-CA 123.498 2.798 . . . . 0.0 113.012 -177.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.633 HG22 HD13 ' A' ' 32' ' ' LEU . 2.6 mp -83.36 110.21 17.96 Favored 'Isoleucine or valine' 0 N--CA 1.384 -3.755 0 N-CA-C 106.534 -1.654 . . . . 0.0 106.534 175.292 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.515 ' HB1' ' CG2' ' A' ' 29' ' ' THR . . . -107.13 132.85 52.56 Favored 'General case' 0 C--N 1.281 -2.387 0 CA-C-N 115.426 -0.806 . . . . 0.0 108.901 178.515 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.549 ' HB2' HD11 ' A' ' 32' ' ' LEU . 5.4 tpt180 -130.33 135.24 47.85 Favored 'General case' 0 N--CA 1.407 -2.616 0 N-CA-C 105.706 -1.961 . . . . 0.0 105.706 -178.505 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -84.23 168.58 15.6 Favored 'General case' 0 C--N 1.272 -2.792 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -175.74 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.433 HG21 ' O ' ' A' ' 25' ' ' ARG . 90.4 t -69.38 148.04 11.67 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.967 0 CA-C-O 122.376 1.084 . . . . 0.0 111.177 -177.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 15.3 m -76.81 -176.05 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.276 -2.589 0 CA-C-N 113.016 -1.902 . . . . 0.0 113.229 -173.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.475 ' CD ' ' H ' ' A' ' 119' ' ' GLU . 0.1 OUTLIER -93.95 -15.56 24.81 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-N 114.703 -1.135 . . . . 0.0 111.665 -176.757 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 27.8 pt20 . . . . . 0 C--N 1.321 -0.651 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 177.125 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.242 0.673 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -161.69 122.39 2.68 Favored 'General case' 0 N--CA 1.441 -0.889 0 N-CA-C 108.825 -0.805 . . . . 0.0 108.825 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -73.5 111.14 8.36 Favored 'General case' 0 N--CA 1.421 -1.894 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 178.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -120.32 -0.41 12.7 Favored Glycine 0 N--CA 1.441 -1.023 0 CA-C-N 115.799 -0.637 . . . . 0.0 112.419 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -89.01 -40.46 6.17 Favored Glycine 0 CA--C 1.492 -1.345 0 N-CA-C 108.009 -2.036 . . . . 0.0 108.009 178.046 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -104.32 -176.41 3.07 Favored 'General case' 0 N--CA 1.42 -1.926 0 N-CA-C 105.868 -1.901 . . . . 0.0 105.868 171.356 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.541 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . -92.8 155.24 17.78 Favored 'General case' 0 C--N 1.285 -2.227 0 C-N-CA 119.708 -0.797 . . . . 0.0 111.213 -179.634 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.607 ' O ' ' HB ' ' A' ' 11' ' ' THR . 19.6 t70 -78.37 157.55 29.04 Favored 'General case' 0 C--O 1.178 -2.7 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 176.327 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.471 ' O ' ' HG3' ' A' ' 13' ' ' ARG . 32.5 mt -59.1 -33.89 71.36 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 118.945 0.793 . . . . 0.0 111.608 -177.065 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.409 ' HA ' ' NH1' ' A' ' 13' ' ' ARG . 18.4 t70 -73.13 -30.0 63.3 Favored 'General case' 0 C--N 1.281 -2.396 0 CA-C-N 114.003 -1.453 . . . . 0.0 108.965 -178.896 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.607 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 56.2 m -78.12 -49.74 13.33 Favored 'General case' 0 N--CA 1.382 -3.837 0 CA-C-N 113.887 -1.506 . . . . 0.0 110.233 177.332 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.521 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 25.7 mt-30 -55.42 -57.29 12.47 Favored 'General case' 0 C--N 1.346 0.443 0 C-N-CA 123.171 0.588 . . . . 0.0 112.132 -172.243 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.607 ' HG2' HG13 ' A' ' 45' ' ' VAL . 42.4 mtm-85 -44.64 -54.28 6.32 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-O 121.698 0.761 . . . . 0.0 109.896 177.657 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 59.7 m -65.63 -48.92 70.59 Favored 'General case' 0 N--CA 1.419 -2.004 0 CA-C-N 113.467 -1.697 . . . . 0.0 112.732 -172.187 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -66.54 -35.27 79.82 Favored 'General case' 0 C--N 1.314 -0.977 0 C-N-CA 124.169 0.988 . . . . 0.0 109.841 -175.281 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 30.4 mm -77.67 -44.53 29.17 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.303 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.769 176.783 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.15 -35.87 67.65 Favored 'General case' 0 CA--C 1.493 -1.239 0 CA-C-O 121.349 0.595 . . . . 0.0 109.558 -176.468 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 3.0 m -54.87 -42.77 72.47 Favored 'General case' 0 N--CA 1.394 -3.266 0 C-N-CA 126.017 1.727 . . . . 0.0 112.069 177.799 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.568 HD11 ' HE3' ' A' ' 99' ' ' LYS . 64.4 mt -83.7 -23.48 31.67 Favored 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -171.321 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.92 -26.46 68.32 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 122.046 0.927 . . . . 0.0 109.999 170.539 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -91.22 -36.15 14.1 Favored 'General case' 0 C--N 1.29 -1.984 0 CA-C-N 114.081 -1.418 . . . . 0.0 110.633 -173.683 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 93.5 m -47.35 139.32 6.57 Favored 'General case' 0 N--CA 1.409 -2.515 0 C-N-CA 125.086 1.354 . . . . 0.0 111.697 173.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.2 t -90.57 166.27 13.3 Favored 'General case' 0 N--CA 1.41 -2.444 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.001 -172.132 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.532 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP . 0.5 OUTLIER -119.23 166.43 12.99 Favored 'General case' 0 N--CA 1.413 -2.297 0 CA-C-N 115.018 -0.992 . . . . 0.0 113.443 -179.105 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.478 ' O ' HG21 ' A' ' 117' ' ' VAL . 32.7 mmm180 -139.07 138.72 37.36 Favored 'General case' 0 CA--C 1.489 -1.399 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 179.354 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -62.22 109.65 1.38 Allowed 'General case' 0 C--N 1.301 -1.513 0 CA-C-O 121.994 0.902 . . . . 0.0 113.227 -177.016 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 128.44 -16.86 5.92 Favored Glycine 0 N--CA 1.423 -2.177 0 CA-C-N 113.854 -1.521 . . . . 0.0 110.01 -174.466 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 39.2 t0 -73.16 155.58 39.48 Favored 'General case' 0 CA--C 1.502 -0.897 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 18.6 m -115.83 123.88 49.28 Favored 'General case' 0 C--N 1.28 -2.456 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 -177.314 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.532 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 15.9 m95 -112.97 162.36 15.95 Favored 'General case' 0 C--N 1.285 -2.198 0 N-CA-C 107.707 -1.22 . . . . 0.0 107.707 178.708 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.463 ' CD1' ' HA ' ' A' ' 94' ' ' THR . 52.2 m-85 -117.56 141.93 47.78 Favored 'General case' 0 C--N 1.274 -2.694 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.679 ' HA ' ' O ' ' A' ' 90' ' ' ILE 0.414 0.4 OUTLIER -106.36 132.05 52.85 Favored 'General case' 0 N--CA 1.424 -1.741 0 N-CA-C 114.385 1.254 . . . . 0.0 114.385 179.525 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.438 HG12 ' O ' ' A' ' 34' ' ' ASP . 89.9 t -110.49 151.21 12.74 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.485 0 CA-C-N 112.403 -2.18 . . . . 0.0 106.4 -176.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.499 ' OD1' ' HG2' ' A' ' 36' ' ' ARG . 18.7 t0 -72.91 131.69 42.53 Favored 'General case' 0 C--N 1.296 -1.723 0 N-CA-C 106.895 -1.521 . . . . 0.0 106.895 171.411 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.4 t -71.94 -22.7 61.43 Favored 'General case' 0 N--CA 1.422 -1.864 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 -171.263 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.564 HH11 ' HG2' ' A' ' 36' ' ' ARG . 9.3 mmt-85 -70.49 -36.91 74.08 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.413 -177.346 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.416 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 71.5 t90 -70.94 -43.19 68.67 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 178.914 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.521 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 41.3 t80 -61.29 -41.83 97.63 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.096 179.024 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.48 ' HA ' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -53.03 -45.58 68.06 Favored 'General case' 0 N--CA 1.425 -1.682 0 C-N-CA 122.426 0.29 . . . . 0.0 111.183 174.106 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.416 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 5.9 tp-100 -64.09 -39.49 94.17 Favored 'General case' 0 N--CA 1.426 -1.661 0 C-N-CA 124.059 0.944 . . . . 0.0 110.74 179.039 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 65.6 t90 -61.35 -38.08 85.67 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.847 176.738 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.521 ' HG3' ' O ' ' A' ' 38' ' ' PHE . 33.1 mtmt -59.15 -41.06 87.45 Favored 'General case' 0 CA--C 1.5 -0.971 0 CA-C-O 120.712 0.291 . . . . 0.0 111.268 -179.049 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.537 ' HG2' ' OD2' ' A' ' 51' ' ' ASP . 18.5 mtpp -66.94 -36.58 82.55 Favored 'General case' 0 C--N 1.311 -1.109 0 CA-C-N 115.101 -0.954 . . . . 0.0 108.818 -176.416 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.634 ' O ' ' HA ' ' A' ' 55' ' ' MET . 0.1 OUTLIER -79.37 -36.46 39.22 Favored 'General case' 0 N--CA 1.436 -1.129 0 CA-C-N 114.504 -1.225 . . . . 0.0 111.876 -177.885 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.607 HG13 ' HG2' ' A' ' 13' ' ' ARG . 3.5 p -89.29 -18.63 7.75 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.087 0 O-C-N 121.973 -0.454 . . . . 0.0 111.896 -177.087 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.625 ' HA2' ' HB2' ' A' ' 52' ' ' LYS . . . 81.93 34.11 25.16 Favored Glycine 0 N--CA 1.428 -1.887 0 N-CA-C 111.924 -0.47 . . . . 0.0 111.924 -176.363 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.419 ' HB3' ' HB3' ' A' ' 42' ' ' LYS . 35.6 t80 -68.86 -42.43 77.08 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 123.055 0.542 . . . . 0.0 110.204 -179.341 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -86.96 126.43 34.71 Favored 'General case' 0 CA--C 1.498 -1.056 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 177.033 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.3 m -60.3 -36.26 77.47 Favored 'General case' 0 C--N 1.304 -1.38 0 CA-C-O 121.014 0.435 . . . . 0.0 112.079 -178.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 45.5 p90 -91.36 -7.67 50.2 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.586 -177.765 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.537 ' OD2' ' HG2' ' A' ' 43' ' ' LYS . 28.7 t70 -136.88 85.44 2.14 Favored 'General case' 0 CA--C 1.485 -1.552 0 CA-C-O 122.014 0.911 . . . . 0.0 110.439 -177.168 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.625 ' HB2' ' HA2' ' A' ' 46' ' ' GLY . 64.3 pttt -160.5 13.05 0.11 Allowed 'General case' 0 N--CA 1.432 -1.362 0 CA-C-N 113.73 -1.577 . . . . 0.0 112.768 -173.561 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 43.2 m-85 -68.64 -3.86 13.43 Favored 'General case' 0 C--N 1.287 -2.125 0 CA-C-O 121.932 0.872 . . . . 0.0 109.254 176.405 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.487 HE21 ' HE3' ' A' ' 43' ' ' LYS . 0.4 OUTLIER -112.45 17.34 19.38 Favored 'General case' 0 N--CA 1.403 -2.79 0 CA-C-N 114.887 -1.051 . . . . 0.0 109.47 -177.309 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 55' ' ' MET . . . . . 0.634 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 51.6 ttp -62.83 105.11 0.62 Allowed 'General case' 0 N--CA 1.413 -2.289 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.561 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 74.99 29.31 60.94 Favored Glycine 0 N--CA 1.437 -1.269 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.124 -176.703 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -102.79 154.25 19.36 Favored 'General case' 0 N--CA 1.444 -0.732 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 -177.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 29.7 pt20 -83.27 -17.26 43.2 Favored 'General case' 0 C--N 1.301 -1.525 0 CA-C-O 121.709 0.766 . . . . 0.0 109.986 -177.254 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 28.0 m-80 -61.18 -24.01 66.0 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 114.784 -1.098 . . . . 0.0 111.959 179.05 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 22.2 m -117.61 -21.4 4.85 Favored 'Isoleucine or valine' 0 CA--C 1.457 -2.633 0 N-CA-C 113.094 0.776 . . . . 0.0 113.094 -176.758 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . 0.311 2.4 p90 -33.73 102.38 0.21 Allowed Pre-proline 0 CA--C 1.545 0.766 0 O-C-N 126.179 2.174 . . . . 0.0 114.901 -159.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -75.15 102.44 1.59 Allowed 'Trans proline' 0 N--CA 1.426 -2.469 0 C-N-CA 122.9 2.4 . . . . 0.0 110.384 176.586 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -73.42 -144.12 0.68 Allowed Glycine 0 C--N 1.28 -2.555 0 CA-C-N 114.078 -1.419 . . . . 0.0 112.624 176.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_exo -56.98 133.57 58.82 Favored 'Trans proline' 0 C--O 1.246 0.897 0 C-N-CA 122.926 2.417 . . . . 0.0 112.417 -177.726 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.534 HD11 ' HB3' ' A' ' 100' ' ' LEU . 54.8 mt -62.16 114.02 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.361 0 CA-C-N 114.966 -1.016 . . . . 0.0 110.47 -177.689 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.473 ' HB2' ' SD ' ' A' ' 107' ' ' MET . 7.9 t70 -97.98 113.94 25.93 Favored 'General case' 0 CA--C 1.489 -1.381 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 173.463 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.444 ' O ' HD23 ' A' ' 71' ' ' LEU . 13.6 m120 -89.85 -15.06 33.04 Favored 'General case' 0 C--N 1.286 -2.167 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.672 178.868 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 6.0 m -53.03 -18.2 1.91 Allowed 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 114.995 1.479 . . . . 0.0 114.995 -168.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -76.65 -3.01 77.87 Favored Glycine 0 CA--C 1.527 0.81 0 C-N-CA 120.932 -0.651 . . . . 0.0 113.107 -178.771 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.423 HD21 ' HA ' ' A' ' 34' ' ' ASP . 39.5 mt -107.44 -17.39 14.13 Favored 'General case' 0 C--O 1.243 0.734 0 CA-C-O 122.253 1.025 . . . . 0.0 109.335 -179.344 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.444 HD23 ' O ' ' A' ' 67' ' ' ASN . 2.7 mm? -84.01 163.8 19.71 Favored 'General case' 0 N--CA 1.401 -2.918 0 CA-C-N 113.679 -1.6 . . . . 0.0 112.198 -173.22 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.8 mttt -74.37 -176.23 2.61 Favored 'General case' 0 C--N 1.301 -1.51 0 CA-C-N 114.527 -1.215 . . . . 0.0 113.444 -178.324 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -84.98 35.3 0.57 Allowed 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 115.021 -0.991 . . . . 0.0 112.58 -173.175 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -166.43 -69.08 0.03 OUTLIER Glycine 0 N--CA 1.428 -1.845 0 C-N-CA 120.184 -1.007 . . . . 0.0 112.878 179.2 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -86.54 139.23 31.05 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-O 121.406 0.622 . . . . 0.0 111.742 -177.39 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -87.38 2.8 49.32 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.711 -179.264 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.712 ' HA ' HE21 ' A' ' 77' ' ' GLN . 0.0 OUTLIER -118.91 -1.2 11.05 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-O 121.809 0.814 . . . . 0.0 109.787 177.591 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 50.5 m -100.66 108.73 20.68 Favored 'General case' 0 C--N 1.281 -2.409 0 CA-C-N 114.407 -1.269 . . . . 0.0 111.137 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 87.1 mt -73.62 153.87 39.99 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.335 -178.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.443 ' HB2' ' CD1' ' A' ' 83' ' ' LEU . 98.9 mttt -78.78 165.83 23.13 Favored 'General case' 0 N--CA 1.426 -1.633 0 C-N-CA 119.734 -0.787 . . . . 0.0 109.202 170.579 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -82.46 -58.87 2.74 Favored 'General case' 0 C--N 1.285 -2.238 0 N-CA-C 113.799 1.037 . . . . 0.0 113.799 -171.901 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -74.96 12.57 0.83 Allowed 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 116.692 2.108 . . . . 0.0 116.692 -168.253 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.443 ' CD1' ' HB2' ' A' ' 80' ' ' LYS . 8.1 mp -73.78 169.11 18.04 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-O 121.547 0.689 . . . . 0.0 111.884 176.295 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.539 HG21 HD12 ' A' ' 87' ' ' LEU . 48.3 mt -137.33 166.88 24.19 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.575 0 N-CA-C 105.747 -1.945 . . . . 0.0 105.747 -178.013 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.572 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 65.9 t0 -56.24 -142.56 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.405 0 C-N-CA 126.498 1.919 . . . . 0.0 110.082 178.682 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.55 ' HA ' ' O ' ' A' ' 89' ' ' TYR . 7.5 pt-20 -39.09 -19.03 0.01 OUTLIER 'General case' 0 N--CA 1.533 3.694 0 N-CA-C 116.663 2.097 . . . . 0.0 116.663 -172.737 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.539 HD12 HG21 ' A' ' 84' ' ' ILE . 14.5 mt -67.87 -53.95 22.7 Favored 'General case' 0 C--N 1.281 -2.372 0 C-N-CA 123.891 0.876 . . . . 0.0 110.478 175.459 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -108.44 -30.85 8.08 Favored 'General case' 0 C--O 1.216 -0.667 0 CA-C-O 121.4 0.619 . . . . 0.0 110.993 -175.057 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' TYR . . . . . 0.572 ' CE1' ' HA ' ' A' ' 85' ' ' ASP . 8.7 p90 -142.32 -168.81 2.81 Favored 'General case' 0 C--O 1.173 -2.934 0 N-CA-C 104.738 -2.319 . . . . 0.0 104.738 177.542 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.679 ' O ' ' HA ' ' A' ' 32' ' ' LEU . 2.4 mt -144.7 141.07 23.7 Favored 'Isoleucine or valine' 0 CA--C 1.458 -2.578 0 CA-C-N 121.425 1.92 . . . . 0.0 109.47 173.638 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.502 ' CD2' ' HB3' ' A' ' 32' ' ' LEU . 77.9 mt -107.33 132.03 53.57 Favored 'General case' 0 C--N 1.274 -2.696 0 O-C-N 124.619 1.2 . . . . 0.0 110.792 176.739 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.401 HD12 ' N ' ' A' ' 92' ' ' LEU . 2.1 mp -141.67 156.65 66.15 Favored Pre-proline 0 C--N 1.276 -2.618 0 N-CA-C 106.8 -1.555 . . . . 0.0 106.8 -177.876 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.412 ' HD2' ' HB3' ' A' ' 19' ' ' LEU . 32.1 Cg_exo -61.23 167.77 8.77 Favored 'Trans proline' 0 C--O 1.26 1.578 0 C-N-CA 122.028 1.819 . . . . 0.0 110.218 174.738 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.463 ' HA ' ' CD1' ' A' ' 31' ' ' TYR . 32.4 m -49.86 -42.42 47.6 Favored 'General case' 0 C--N 1.306 -1.321 0 O-C-N 123.901 0.751 . . . . 0.0 110.231 176.527 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.492 ' O ' ' HG3' ' A' ' 99' ' ' LYS . 6.3 mm-40 -58.88 -50.34 74.39 Favored 'General case' 0 C--O 1.198 -1.609 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.89 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.581 ' O ' HD22 ' A' ' 100' ' ' LEU . . . -50.45 -58.11 9.49 Favored Glycine 0 CA--C 1.492 -1.362 0 O-C-N 124.153 0.908 . . . . 0.0 111.555 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 66.7 t-105 -54.65 -49.5 70.41 Favored 'General case' 0 C--N 1.311 -1.077 0 C-N-CA 123.169 0.588 . . . . 0.0 110.934 177.267 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -55.36 -31.11 61.5 Favored 'General case' 0 CA--C 1.496 -1.105 0 C-N-CA 123.088 0.555 . . . . 0.0 112.431 177.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.568 ' HE3' HD11 ' A' ' 19' ' ' LEU . 59.2 mttm -72.82 -51.4 19.04 Favored 'General case' 0 N--CA 1.411 -2.388 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 178.689 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.581 HD22 ' O ' ' A' ' 96' ' ' GLY . 0.6 OUTLIER -60.7 -39.25 87.83 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.426 0.632 . . . . 0.0 111.153 -179.563 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.551 ' HA ' ' HA ' ' A' ' 105' ' ' THR . 21.3 t -72.89 -28.14 26.32 Favored 'Isoleucine or valine' 0 N--CA 1.403 -2.823 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.774 177.514 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 18.6 t -76.04 -35.45 59.46 Favored 'General case' 0 C--N 1.297 -1.696 0 O-C-N 121.228 -0.92 . . . . 0.0 109.101 178.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' TRP . . . . . 0.54 ' CZ2' ' HB3' ' A' ' 99' ' ' LYS . 28.2 m0 -80.66 -48.44 12.61 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.02 -175.371 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -126.02 -2.14 7.1 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 114.185 1.18 . . . . 0.0 114.185 -177.118 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.551 ' HA ' ' HA ' ' A' ' 101' ' ' VAL 0.351 14.3 t 52.74 175.1 0.02 OUTLIER 'General case' 0 CA--C 1.509 -0.596 0 CA-C-O 123.688 1.708 . . . . 0.0 115.135 -175.59 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 54.4 tp -95.82 160.36 14.51 Favored 'General case' 1 C--N 1.231 -4.553 0 CA-C-N 111.941 -2.39 . . . . 0.0 107.072 -178.023 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.525 ' HG3' ' O ' ' A' ' 65' ' ' ILE . 37.3 mtp -68.62 155.67 39.58 Favored 'General case' 0 CA--C 1.487 -1.479 0 C-N-CA 119.045 -1.062 . . . . 0.0 108.811 175.311 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -84.43 132.53 34.56 Favored 'General case' 0 C--N 1.258 -3.379 0 CA-C-N 115.446 -0.797 . . . . 0.0 113.059 177.671 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 111.68 -37.37 3.72 Favored Glycine 0 N--CA 1.397 -3.908 0 CA-C-N 114.068 -1.424 . . . . 0.0 110.875 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -93.38 159.69 15.14 Favored 'General case' 0 N--CA 1.422 -1.857 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 178.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' GLU . . . . . 0.53 ' HB2' ' OE1' ' A' ' 77' ' ' GLN . 45.3 mt-10 -131.65 154.13 81.73 Favored Pre-proline 0 C--N 1.285 -2.223 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 -177.137 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -54.04 142.43 65.46 Favored 'Trans proline' 0 CA--C 1.458 -3.321 0 C-N-CA 124.13 3.22 . . . . 0.0 114.521 -175.264 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.477 ' O ' HD23 ' A' ' 32' ' ' LEU . 2.7 mp -100.51 113.8 37.38 Favored 'Isoleucine or valine' 1 N--CA 1.367 -4.604 0 CA-C-N 113.844 -1.526 . . . . 0.0 107.267 175.035 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -100.09 139.51 35.65 Favored 'General case' 0 C--N 1.281 -2.391 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.745 176.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.44 ' HB2' HD22 ' A' ' 32' ' ' LEU . 19.2 tpt180 -134.09 129.3 35.79 Favored 'General case' 0 C--N 1.293 -1.876 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 -177.682 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -79.58 163.29 24.76 Favored 'General case' 0 C--N 1.28 -2.435 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.677 177.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.478 HG21 ' O ' ' A' ' 25' ' ' ARG . 57.4 t -57.41 153.94 2.36 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.09 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.797 175.521 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 25.0 m -48.68 138.07 4.0 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.405 0 C-N-CA 125.228 1.411 . . . . 0.0 113.688 -176.191 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -87.77 -7.88 56.74 Favored 'General case' 0 C--N 1.275 -2.657 0 CA-C-N 112.635 -2.075 . . . . 0.0 109.776 -174.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 . . . . . 0 C--N 1.291 -1.955 0 CA-C-N 114.404 -1.271 . . . . 0.0 110.128 175.334 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.6 mmm . . . . . 0 CA--C 1.5 -0.943 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 69.66 147.48 0.07 Allowed 'General case' 0 C--O 1.243 0.744 0 C-N-CA 125.435 1.494 . . . . 0.0 113.401 178.668 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -87.87 138.64 31.28 Favored 'General case' 0 N--CA 1.416 -2.154 0 N-CA-C 107.322 -1.362 . . . . 0.0 107.322 175.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -166.87 45.99 0.26 Allowed Glycine 0 N--CA 1.437 -1.249 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.548 179.173 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.507 ' O ' ' HA ' ' A' ' 103' ' ' TRP . . . -171.34 23.99 0.09 OUTLIER Glycine 0 C--O 1.224 -0.511 0 C-N-CA 120.203 -0.998 . . . . 0.0 113.314 178.498 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.488 ' HA ' ' CD1' ' A' ' 103' ' ' TRP . . . -121.64 177.37 5.27 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 113.491 0.923 . . . . 0.0 113.491 -175.858 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.545 ' HB3' ' HG2' ' A' ' 12' ' ' GLN . . . -87.11 -177.13 5.94 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-N 114.336 -1.302 . . . . 0.0 109.489 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.649 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 9.8 t70 -71.32 140.36 50.24 Favored 'General case' 0 N--CA 1.427 -1.582 0 N-CA-C 106.746 -1.575 . . . . 0.0 106.746 173.821 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 65.0 mt -54.29 -40.79 68.22 Favored 'General case' 0 C--N 1.305 -1.353 0 CA-C-O 121.232 0.539 . . . . 0.0 110.482 -179.112 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -65.12 -39.9 93.74 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 114.318 -1.31 . . . . 0.0 110.033 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.422 ' HB ' ' HB3' ' A' ' 8' ' ' ASP . 2.3 m -66.75 -49.53 65.67 Favored 'General case' 0 N--CA 1.401 -2.877 0 CA-C-N 114.829 -1.078 . . . . 0.0 109.578 179.663 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.649 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 23.9 mt-30 -56.35 -44.87 80.52 Favored 'General case' 0 CA--C 1.474 -1.957 0 CA-C-N 114.914 -1.039 . . . . 0.0 111.225 -179.052 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.967 ' HD3' HG21 ' A' ' 45' ' ' VAL 0.268 10.3 mmm180 -69.56 -30.77 68.65 Favored 'General case' 0 N--CA 1.405 -2.685 0 N-CA-C 115.092 1.516 . . . . 0.0 115.092 -177.193 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.8 t -78.92 -46.21 18.89 Favored 'General case' 0 C--N 1.261 -3.279 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 179.831 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.519 ' O ' ' HB ' ' A' ' 18' ' ' THR . 11.1 t0 -59.83 -48.15 82.86 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 124.016 0.926 . . . . 0.0 109.624 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.621 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 12.4 mm -72.5 -39.07 61.56 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.207 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.611 -177.979 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.52 ' O ' ' HG2' ' A' ' 21' ' ' LYS . . . -57.94 -35.11 70.66 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 177.657 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.59 ' HA ' ' HE2' ' A' ' 21' ' ' LYS . 1.8 m -64.94 -43.39 92.89 Favored 'General case' 0 N--CA 1.399 -2.986 0 CA-C-N 114.183 -1.372 . . . . 0.0 111.786 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.554 ' HB3' ' CG ' ' A' ' 93' ' ' PRO . 88.8 mt -75.31 -12.87 60.36 Favored 'General case' 0 C--N 1.268 -2.955 0 N-CA-C 113.207 0.817 . . . . 0.0 113.207 -175.891 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.621 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 17.5 mt -86.22 -29.17 23.37 Favored 'General case' 0 C--N 1.309 -1.185 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 176.283 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.59 ' HE2' ' HA ' ' A' ' 18' ' ' THR . 54.4 pttt -96.32 -18.75 19.75 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-N 115.516 -0.766 . . . . 0.0 111.511 -175.186 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.6 m -53.46 131.71 38.61 Favored 'General case' 0 N--CA 1.399 -3.005 0 CA-C-O 122.251 1.024 . . . . 0.0 111.254 170.748 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 59.5 m -65.67 141.24 58.44 Favored 'General case' 0 N--CA 1.406 -2.634 0 CA-C-N 113.355 -1.748 . . . . 0.0 112.527 -178.867 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.412 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP . 0.4 OUTLIER -112.13 159.88 18.09 Favored 'General case' 0 N--CA 1.41 -2.455 0 CA-C-N 114.948 -1.023 . . . . 0.0 112.738 179.864 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 28.3 mmt85 -130.86 144.69 51.64 Favored 'General case' 0 C--N 1.288 -2.082 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.365 -177.79 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 18.0 pttm -66.12 97.03 0.35 Allowed 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 122.213 1.006 . . . . 0.0 109.56 177.009 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 147.43 -17.44 1.49 Allowed Glycine 0 N--CA 1.427 -1.909 0 CA-C-N 113.636 -1.62 . . . . 0.0 109.965 -172.84 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -77.42 145.65 37.04 Favored 'General case' 0 CA--C 1.499 -0.986 0 CA-C-O 120.855 0.36 . . . . 0.0 110.113 177.324 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.402 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 58.8 m -104.44 132.71 50.38 Favored 'General case' 0 C--N 1.293 -1.877 0 N-CA-C 107.518 -1.289 . . . . 0.0 107.518 176.172 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.412 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 22.6 m95 -121.83 143.8 49.2 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 -178.9 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.44 ' HB2' ' HB2' ' A' ' 97' ' ' TRP . 57.6 m-85 -107.04 141.03 38.92 Favored 'General case' 0 C--N 1.28 -2.452 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.842 -174.832 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.51 ' HA ' ' O ' ' A' ' 90' ' ' ILE . 5.9 mp -93.21 135.64 34.22 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 122.048 0.927 . . . . 0.0 112.799 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.501 HG23 HD23 ' A' ' 92' ' ' LEU . 73.7 t -116.14 136.8 51.94 Favored 'Isoleucine or valine' 0 C--N 1.28 -2.45 0 N-CA-C 105.776 -1.935 . . . . 0.0 105.776 171.478 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.523 ' OD1' ' HG2' ' A' ' 36' ' ' ARG . 19.7 t0 -63.19 126.94 29.06 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 169.008 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.566 ' OG ' ' HE3' ' A' ' 39' ' ' LYS . 48.4 t -67.88 -23.86 65.17 Favored 'General case' 0 C--N 1.287 -2.15 0 CA-C-N 115.311 -0.858 . . . . 0.0 109.831 -171.741 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.523 ' HG2' ' OD1' ' A' ' 34' ' ' ASP . 17.3 mmt-85 -62.24 -40.68 96.98 Favored 'General case' 0 C--O 1.239 0.52 0 N-CA-C 109.603 -0.518 . . . . 0.0 109.603 -178.168 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.454 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 51.4 t90 -68.34 -45.52 72.65 Favored 'General case' 0 C--O 1.227 -0.094 0 CA-C-N 115.304 -0.862 . . . . 0.0 108.784 179.197 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.519 ' CG ' HD12 ' A' ' 90' ' ' ILE . 17.8 t80 -65.65 -34.56 78.51 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.984 -177.06 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.566 ' HE3' ' OG ' ' A' ' 35' ' ' SER . 96.7 mttt -68.51 -32.73 72.89 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-O 120.707 0.289 . . . . 0.0 111.438 176.395 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.454 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 5.2 tp-100 -67.66 -41.61 83.5 Favored 'General case' 0 N--CA 1.412 -2.346 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 174.909 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.667 ' O ' HG22 ' A' ' 45' ' ' VAL . 52.8 t90 -65.67 -40.37 92.33 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 114.902 -1.044 . . . . 0.0 110.121 178.384 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.435 ' HD3' ' HA ' ' A' ' 39' ' ' LYS . 13.4 mtpp -52.06 -43.36 63.78 Favored 'General case' 0 C--O 1.216 -0.697 0 C-N-CA 124.408 1.083 . . . . 0.0 113.398 178.291 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 45.7 mttm -74.7 -40.89 61.07 Favored 'General case' 0 C--N 1.303 -1.422 0 C-N-CA 119.809 -0.756 . . . . 0.0 111.207 179.647 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.57 ' HB2' HG23 ' A' ' 60' ' ' VAL . 4.2 t80 -55.81 -33.92 64.88 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-N 114.389 -1.278 . . . . 0.0 111.933 179.752 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.967 HG21 ' HD3' ' A' ' 13' ' ' ARG . 3.4 m -94.41 -23.54 5.18 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.826 0 N-CA-C 112.608 0.595 . . . . 0.0 112.608 176.832 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.567 ' CA ' ' HG3' ' A' ' 52' ' ' LYS . . . 81.83 38.82 12.85 Favored Glycine 1 N--CA 1.391 -4.339 0 C-N-CA 120.033 -1.079 . . . . 0.0 110.498 -172.887 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.524 ' HB2' ' HE ' ' A' ' 13' ' ' ARG . 42.4 t80 -59.66 -49.4 77.89 Favored 'General case' 0 N--CA 1.433 -1.289 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 176.825 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -73.22 114.47 11.44 Favored 'General case' 0 N--CA 1.429 -1.519 0 CA-C-N 113.651 -1.613 . . . . 0.0 108.263 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 5.7 m -55.56 -27.44 49.09 Favored 'General case' 0 C--N 1.3 -1.571 0 C-N-CA 124.885 1.274 . . . . 0.0 113.206 -175.099 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 44.1 p90 -94.88 -0.91 53.61 Favored 'General case' 0 C--N 1.298 -1.661 0 O-C-N 122.153 -0.342 . . . . 0.0 111.097 -178.135 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -136.34 77.07 1.63 Allowed 'General case' 0 C--N 1.312 -1.028 0 C-N-CA 119.502 -0.879 . . . . 0.0 110.76 -173.58 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.567 ' HG3' ' CA ' ' A' ' 46' ' ' GLY . 0.0 OUTLIER -118.21 23.09 11.81 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-O 121.809 0.814 . . . . 0.0 111.523 177.029 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 74.4 m-85 -77.87 -22.59 49.56 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 176.855 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.463 ' HB3' HG11 ' A' ' 60' ' ' VAL . 13.8 mm-40 -95.57 -0.68 51.71 Favored 'General case' 0 N--CA 1.419 -2.02 0 C-N-CA 124.733 1.213 . . . . 0.0 110.283 -179.02 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 53.4 ttp -66.18 115.72 6.48 Favored 'General case' 0 N--CA 1.419 -1.994 0 CA-C-O 121.34 0.59 . . . . 0.0 110.672 -176.184 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 79.15 12.73 83.7 Favored Glycine 0 N--CA 1.437 -1.285 0 CA-C-N 115.065 -0.971 . . . . 0.0 111.512 -179.224 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.615 ' HB3' HG22 ' A' ' 60' ' ' VAL . 5.4 t70 -87.06 146.4 26.1 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 -177.527 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.447 ' O ' ' HD2' ' A' ' 61' ' ' TYR . 25.6 pt20 -83.82 -21.51 32.07 Favored 'General case' 0 C--N 1.285 -2.211 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.827 -177.905 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.9 m-80 -65.46 -22.86 66.8 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 121.654 0.74 . . . . 0.0 111.859 178.669 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.615 HG22 ' HB3' ' A' ' 57' ' ' ASP . 32.0 m -116.84 2.66 7.66 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.186 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.449 -173.965 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.447 ' HD2' ' O ' ' A' ' 58' ' ' GLN . 0.3 OUTLIER -68.78 118.32 59.68 Favored Pre-proline 0 C--N 1.313 -1.02 0 C-N-CA 120.115 -0.634 . . . . 0.0 109.969 -179.22 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -92.09 117.74 0.44 Allowed 'Trans proline' 0 N--CA 1.407 -3.563 0 C-N-CA 122.357 2.038 . . . . 0.0 110.455 176.103 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -74.54 -141.17 0.69 Allowed Glycine 0 C--N 1.268 -3.226 0 CA-C-N 114.158 -1.383 . . . . 0.0 111.949 175.593 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.523 ' HA ' ' O ' ' A' ' 104' ' ' TYR . 50.6 Cg_exo -53.69 131.56 44.65 Favored 'Trans proline' 0 C--O 1.251 1.133 0 C-N-CA 122.881 2.387 . . . . 0.0 113.041 -178.024 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 67.9 mt -60.99 122.76 12.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.381 -178.059 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -117.56 127.54 54.08 Favored 'General case' 0 C--N 1.297 -1.676 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.312 -179.574 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.477 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 93.5 m-20 -112.58 10.69 19.55 Favored 'General case' 0 C--N 1.301 -1.5 0 O-C-N 123.83 0.707 . . . . 0.0 111.104 -178.484 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 50.9 m -88.2 78.43 8.08 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 122.22 1.01 . . . . 0.0 111.621 -177.87 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 174.02 -37.77 0.12 Allowed Glycine 0 CA--C 1.48 -2.145 0 N-CA-C 104.91 -3.276 . . . . 0.0 104.91 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.486 HD11 ' HB3' ' A' ' 89' ' ' TYR . 28.8 tp -70.18 -45.6 66.37 Favored 'General case' 1 N--CA 1.374 -4.226 0 CA-C-N 112.221 -1.989 . . . . 0.0 107.769 168.866 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.541 ' O ' ' HE3' ' A' ' 80' ' ' LYS . 75.3 mt -71.05 159.75 34.16 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 114.643 -1.162 . . . . 0.0 109.64 175.254 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.401 ' HG2' ' HG2' ' A' ' 80' ' ' LYS . 41.8 mtpt -74.51 -170.51 1.03 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.776 0.322 . . . . 0.0 111.224 -178.328 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -76.23 96.58 3.95 Favored 'General case' 0 CA--C 1.494 -1.177 0 CA-C-O 121.285 0.564 . . . . 0.0 111.07 -178.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 92.08 -175.55 38.24 Favored Glycine 0 N--CA 1.418 -2.501 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.275 179.335 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.496 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 17.1 t0 72.16 -49.49 0.69 Allowed 'General case' 0 N--CA 1.499 2.004 0 C-N-CA 126.395 1.878 . . . . 0.0 113.255 179.05 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.435 ' HA ' HD13 ' A' ' 71' ' ' LEU . . . 62.86 24.02 14.32 Favored 'General case' 0 C--N 1.262 -3.203 0 C-N-CA 127.846 2.458 . . . . 0.0 111.69 -177.616 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.496 ' HG2' ' O ' ' A' ' 75' ' ' ASP . 10.7 mm-40 -130.02 2.78 4.81 Favored 'General case' 0 C--N 1.291 -1.937 0 N-CA-C 105.95 -1.87 . . . . 0.0 105.95 179.553 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.5 p -105.51 123.29 47.64 Favored 'General case' 0 C--N 1.293 -1.874 0 CA-C-N 114.107 -1.406 . . . . 0.0 113.074 -171.119 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.414 HD11 HG21 ' A' ' 113' ' ' ILE . 71.5 mt -93.72 138.54 31.82 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-O 120.736 0.303 . . . . 0.0 110.381 175.93 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.541 ' HE3' ' O ' ' A' ' 71' ' ' LEU . 99.1 mttt -72.35 139.87 48.15 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-O 121.32 0.581 . . . . 0.0 110.753 176.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -65.42 -18.17 65.1 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 122.011 0.91 . . . . 0.0 110.597 176.842 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 8.8 t-80 -82.82 -7.16 59.68 Favored 'General case' 0 C--N 1.296 -1.728 0 CA-C-N 114.169 -1.378 . . . . 0.0 110.676 -175.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.467 ' HG ' ' HB2' ' A' ' 80' ' ' LYS . 77.2 mt -76.35 130.48 38.14 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-O 121.148 0.499 . . . . 0.0 112.039 -175.613 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.675 HG21 HD12 ' A' ' 87' ' ' LEU . 50.9 mt -112.39 -179.37 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.29 -2.002 0 N-CA-C 105.645 -1.983 . . . . 0.0 105.645 173.813 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.651 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 13.0 t70 -63.83 -145.14 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.344 0 C-N-CA 124.737 1.215 . . . . 0.0 110.139 -179.342 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.593 ' HA ' ' O ' ' A' ' 89' ' ' TYR 0.254 0.0 OUTLIER -40.63 -17.69 0.01 OUTLIER 'General case' 0 N--CA 1.52 3.036 0 N-CA-C 117.006 2.225 . . . . 0.0 117.006 -175.147 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.675 HD12 HG21 ' A' ' 84' ' ' ILE . 43.4 mt -59.03 -52.48 65.56 Favored 'General case' 0 C--N 1.277 -2.579 0 C-N-CA 123.471 0.708 . . . . 0.0 109.782 170.526 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -112.59 -40.5 4.06 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.987 -176.439 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' TYR . . . . . 0.651 ' CE1' ' HA ' ' A' ' 85' ' ' ASP . 0.8 OUTLIER -135.74 178.43 7.05 Favored 'General case' 0 C--O 1.17 -3.097 0 C-N-CA 119.84 -0.744 . . . . 0.0 109.606 -179.983 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.519 HD12 ' CG ' ' A' ' 38' ' ' PHE . 6.8 mt -139.45 147.98 23.81 Favored 'Isoleucine or valine' 0 N--CA 1.404 -2.735 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 174.612 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.465 ' HA ' HD23 ' A' ' 91' ' ' LEU . 64.4 mt -109.72 129.54 55.6 Favored 'General case' 0 N--CA 1.399 -3.015 0 O-C-N 124.623 1.202 . . . . 0.0 111.008 178.026 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.501 HD23 HG23 ' A' ' 33' ' ' VAL . 1.5 mm? -123.43 150.03 59.74 Favored Pre-proline 0 C--N 1.27 -2.86 0 CA-C-N 113.419 -1.719 . . . . 0.0 106.47 -177.26 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.554 ' CG ' ' HB3' ' A' ' 19' ' ' LEU . 10.2 Cg_endo -64.95 168.34 13.94 Favored 'Trans proline' 0 N--CA 1.428 -2.332 0 N-CA-C 108.296 -1.463 . . . . 0.0 108.296 169.193 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 18.9 m -43.7 -48.12 7.88 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 123.667 0.604 . . . . 0.0 110.732 173.092 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -68.16 -36.39 79.55 Favored 'General case' 0 CA--C 1.485 -1.553 0 CA-C-N 115.509 -0.769 . . . . 0.0 112.401 -178.365 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -58.88 -57.89 17.45 Favored Glycine 0 N--CA 1.417 -2.632 0 N-CA-C 110.168 -1.173 . . . . 0.0 110.168 179.711 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.44 ' HB2' ' HB2' ' A' ' 31' ' ' TYR . 70.0 t-105 -54.63 -50.57 67.8 Favored 'General case' 0 N--CA 1.421 -1.893 0 C-N-CA 123.449 0.7 . . . . 0.0 110.611 174.822 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -50.59 -34.48 26.06 Favored 'General case' 0 C--O 1.215 -0.748 0 C-N-CA 123.029 0.532 . . . . 0.0 112.31 177.583 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 41.7 mttm -70.71 -50.02 40.79 Favored 'General case' 0 CA--C 1.456 -2.644 0 CA-C-O 120.862 0.363 . . . . 0.0 110.375 179.447 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.539 HD23 ' CE3' ' A' ' 103' ' ' TRP . 44.3 mt -65.64 -31.2 72.09 Favored 'General case' 0 C--N 1.264 -3.133 0 CA-C-N 115.078 -0.964 . . . . 0.0 111.804 -176.924 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.536 ' HA ' ' HA ' ' A' ' 105' ' ' THR . 12.7 t -81.06 -24.77 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.402 -2.847 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.319 174.752 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 37.6 t -76.35 -36.44 58.19 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 107.519 -1.289 . . . . 0.0 107.519 177.522 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' TRP . . . . . 0.539 ' CE3' HD23 ' A' ' 100' ' ' LEU . 50.0 m0 -80.9 -53.84 6.1 Favored 'General case' 0 N--CA 1.41 -2.445 0 CA-C-N 114.677 -1.147 . . . . 0.0 112.08 -177.16 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' TYR . . . . . 0.523 ' O ' ' HA ' ' A' ' 64' ' ' PRO . 41.6 m-85 -120.85 -3.38 9.7 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.521 -0.471 . . . . 0.0 112.187 -170.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.536 ' HA ' ' HA ' ' A' ' 101' ' ' VAL 0.265 7.2 t 50.02 -173.46 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.17 0 C-N-CA 126.591 1.956 . . . . 0.0 114.376 -174.132 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 44.9 tp -114.98 144.31 43.8 Favored 'General case' 0 C--N 1.256 -3.483 0 CA-C-N 113.578 -1.646 . . . . 0.0 109.458 -175.347 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.506 ' SD ' ' HB2' ' A' ' 64' ' ' PRO . 65.2 mmm -65.33 156.64 31.47 Favored 'General case' 0 C--O 1.247 0.958 0 CA-C-O 121.584 0.707 . . . . 0.0 110.928 176.682 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -79.83 138.04 37.11 Favored 'General case' 0 C--N 1.278 -2.541 0 CA-C-N 114.77 -1.105 . . . . 0.0 111.951 -176.736 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 101.63 -37.21 3.75 Favored Glycine 0 N--CA 1.415 -2.762 0 CA-C-N 114.754 -1.112 . . . . 0.0 110.384 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 24.5 mp0 -74.97 158.15 33.76 Favored 'General case' 0 CA--C 1.499 -0.991 0 CA-C-O 121.679 0.752 . . . . 0.0 112.043 178.31 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -116.83 157.57 45.96 Favored Pre-proline 0 N--CA 1.408 -2.536 0 N-CA-C 105.364 -2.087 . . . . 0.0 105.364 175.593 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' PRO . . . . . 0.433 ' HB3' ' CE2' ' A' ' 97' ' ' TRP . 13.8 Cg_exo -73.63 122.32 7.74 Favored 'Trans proline' 0 CA--C 1.451 -3.651 0 N-CA-C 108.047 -1.559 . . . . 0.0 108.047 166.858 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.414 HG21 HD11 ' A' ' 79' ' ' LEU . 3.6 mp -83.01 106.96 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.38 -3.956 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 -179.42 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.406 ' O ' ' HD3' ' A' ' 115' ' ' ARG . . . -103.5 129.46 50.68 Favored 'General case' 0 N--CA 1.402 -2.841 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.861 -179.141 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.406 ' HD3' ' O ' ' A' ' 114' ' ' ALA . 21.9 mmt180 -131.23 -172.51 2.86 Favored 'General case' 0 C--N 1.286 -2.154 0 N-CA-C 105.475 -2.046 . . . . 0.0 105.475 177.787 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -130.11 176.35 8.16 Favored 'General case' 0 C--N 1.269 -2.911 0 C-N-CA 118.575 -1.25 . . . . 0.0 111.46 -177.561 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 61.6 t -63.1 141.42 18.15 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.118 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 173.63 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 25.5 m -82.79 164.42 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.39 -3.454 0 CA-C-O 121.823 0.82 . . . . 0.0 112.463 -173.363 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -68.0 -12.09 60.12 Favored 'General case' 0 C--N 1.301 -1.52 0 CA-C-N 113.431 -1.713 . . . . 0.0 112.004 -179.544 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 11.9 mm100 . . . . . 0 C--N 1.309 -1.16 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 -179.254 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.234 0.273 0 N-CA-C 106.526 -1.657 . . . . 0.0 106.526 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -72.32 166.59 22.18 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -172.347 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.421 ' O ' HD23 ' A' ' 9' ' ' LEU . 10.3 mp0 -66.66 120.62 13.77 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 114.328 -1.305 . . . . 0.0 108.893 178.08 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -143.27 -177.01 17.86 Favored Glycine 0 N--CA 1.415 -2.761 0 C-N-CA 120.176 -1.011 . . . . 0.0 112.892 -179.201 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 166.52 103.37 0.17 Allowed Glycine 0 CA--C 1.477 -2.31 0 N-CA-C 106.326 -2.71 . . . . 0.0 106.326 -179.297 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.471 ' HB1' ' CD1' ' A' ' 103' ' ' TRP . . . 66.24 64.42 0.52 Allowed 'General case' 0 CA--C 1.499 -0.998 0 N-CA-C 105.088 -2.189 . . . . 0.0 105.088 -168.279 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.458 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . 73.52 155.34 0.16 Allowed 'General case' 0 CA--C 1.499 -0.989 0 CA-C-N 112.138 -2.301 . . . . 0.0 110.207 -172.346 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.577 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 4.8 p-10 -84.46 153.54 23.29 Favored 'General case' 0 CA--C 1.455 -2.708 0 C-N-CA 118.988 -1.085 . . . . 0.0 109.324 173.598 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.484 ' O ' ' HG3' ' A' ' 13' ' ' ARG . 3.9 mm? -47.5 -46.16 27.01 Favored 'General case' 0 C--N 1.286 -2.19 0 C-N-CA 125.757 1.623 . . . . 0.0 112.1 -178.695 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -67.78 -36.66 80.85 Favored 'General case' 0 C--N 1.257 -3.419 0 CA-C-N 113.064 -1.88 . . . . 0.0 110.273 -177.849 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.458 ' CG2' ' HB1' ' A' ' 7' ' ' ALA . 1.7 m -67.82 -50.21 58.02 Favored 'General case' 0 N--CA 1.395 -3.189 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.393 176.676 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.577 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 87.8 mt-30 -50.92 -53.4 33.15 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 124.0 0.812 . . . . 0.0 111.387 -175.97 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.651 ' HG2' HG13 ' A' ' 45' ' ' VAL . 28.9 mtm180 -48.56 -60.04 3.02 Favored 'General case' 0 N--CA 1.487 1.416 0 CA-C-O 122.137 0.97 . . . . 0.0 110.676 176.777 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.9 m -65.26 -43.51 91.08 Favored 'General case' 0 N--CA 1.424 -1.727 0 CA-C-N 113.379 -1.737 . . . . 0.0 113.091 -171.334 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -68.22 -36.08 78.97 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.451 -176.142 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.511 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 22.9 mm -78.79 -37.77 20.65 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.158 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.248 177.253 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.2 -43.23 92.24 Favored 'General case' 0 CA--C 1.492 -1.279 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 179.689 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.41 ' O ' ' HB ' ' A' ' 22' ' ' THR . 2.3 m -55.43 -39.98 70.94 Favored 'General case' 0 N--CA 1.403 -2.775 0 C-N-CA 125.504 1.522 . . . . 0.0 111.543 178.189 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 78.5 mt -84.29 -13.89 51.25 Favored 'General case' 0 C--N 1.295 -1.799 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -174.381 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 59.7 mt -81.58 -17.54 47.97 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 175.85 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -104.01 -41.44 5.85 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.156 -1.384 . . . . 0.0 111.424 -175.035 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.41 ' HB ' ' O ' ' A' ' 18' ' ' THR . 1.4 t -46.31 167.29 0.02 OUTLIER 'General case' 0 C--O 1.242 0.702 0 C-N-CA 126.35 1.86 . . . . 0.0 114.81 -179.878 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 61.5 m -61.25 127.06 29.68 Favored 'General case' 0 N--CA 1.389 -3.502 0 CA-C-N 111.697 -2.501 . . . . 0.0 112.286 179.414 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.546 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP . 0.3 OUTLIER -111.7 -18.49 12.75 Favored 'General case' 0 C--N 1.283 -2.289 0 CA-C-N 113.797 -1.547 . . . . 0.0 113.116 -177.969 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.626 ' O ' HG11 ' A' ' 117' ' ' VAL . 9.9 mtm180 60.17 -152.67 0.39 Allowed 'General case' 0 C--N 1.253 -3.627 0 CA-C-N 112.838 -1.983 . . . . 0.0 109.09 -178.314 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 57.7 mtmt -126.43 29.02 5.85 Favored 'General case' 0 C--N 1.292 -1.91 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 172.638 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -153.3 33.33 0.78 Allowed Glycine 0 N--CA 1.435 -1.368 0 CA-C-N 114.33 -1.305 . . . . 0.0 113.074 -179.084 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.48 ' H ' HG23 ' A' ' 117' ' ' VAL . 7.9 t70 -109.56 173.45 6.32 Favored 'General case' 0 N--CA 1.484 1.264 0 N-CA-C 106.954 -1.498 . . . . 0.0 106.954 177.891 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.406 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 85.9 m -122.19 121.19 36.27 Favored 'General case' 0 C--N 1.282 -2.331 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.546 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 17.4 m95 -103.31 126.74 50.63 Favored 'General case' 0 N--CA 1.388 -3.564 0 CA-C-N 114.662 -1.153 . . . . 0.0 109.388 -179.249 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.446 ' HB2' ' HB2' ' A' ' 97' ' ' TRP . 82.8 m-85 -98.38 144.47 27.72 Favored 'General case' 0 C--N 1.272 -2.782 0 CA-C-N 115.065 -0.971 . . . . 0.0 110.975 -175.567 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.55 ' CD1' HD21 ' A' ' 91' ' ' LEU . 6.1 mp -93.5 141.9 27.95 Favored 'General case' 0 N--CA 1.426 -1.665 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.971 -177.254 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.547 ' CG1' ' HB ' ' A' ' 90' ' ' ILE . 0.6 OUTLIER -133.11 142.24 42.62 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.756 0 CA-C-N 114.377 -1.283 . . . . 0.0 108.365 174.963 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.482 ' OD1' ' HB2' ' A' ' 36' ' ' ARG . 10.5 t70 -61.13 128.98 39.08 Favored 'General case' 0 C--N 1.305 -1.349 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 176.205 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.507 ' O ' ' HD3' ' A' ' 39' ' ' LYS . 19.5 p -61.58 -34.86 76.33 Favored 'General case' 0 C--O 1.209 -1.028 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 -173.721 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.482 ' HB2' ' OD1' ' A' ' 34' ' ' ASP . 0.0 OUTLIER -64.13 -36.7 84.88 Favored 'General case' 0 CA--C 1.482 -1.667 0 CA-C-O 121.23 0.538 . . . . 0.0 111.204 -176.564 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.509 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 51.1 t90 -63.32 -44.04 96.08 Favored 'General case' 0 C--N 1.287 -2.131 0 CA-C-N 113.992 -1.458 . . . . 0.0 108.266 178.164 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -69.64 -43.17 73.17 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.829 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.507 ' HD3' ' O ' ' A' ' 35' ' ' SER . 14.6 mptt -55.38 -32.74 62.86 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 122.601 0.361 . . . . 0.0 111.937 171.89 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.509 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 62.6 tp60 -72.32 -46.62 54.82 Favored 'General case' 0 N--CA 1.419 -2.016 0 C-N-CA 123.22 0.608 . . . . 0.0 109.464 176.727 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 72.6 t90 -58.4 -39.22 79.11 Favored 'General case' 0 C--O 1.213 -0.821 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.871 177.73 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.517 ' HG2' ' CD1' ' A' ' 47' ' ' PHE . 15.3 mtpp -56.39 -40.0 73.89 Favored 'General case' 0 N--CA 1.44 -0.942 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.428 ' HB3' ' HG3' ' A' ' 54' ' ' GLN . 39.6 mttp -72.31 -44.67 62.37 Favored 'General case' 0 C--N 1.293 -1.87 0 CA-C-O 121.133 0.492 . . . . 0.0 110.25 177.478 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.688 ' HB2' HG23 ' A' ' 60' ' ' VAL . 1.0 OUTLIER -58.12 -39.1 77.83 Favored 'General case' 0 N--CA 1.418 -2.072 0 CA-C-N 114.524 -1.217 . . . . 0.0 110.948 -179.226 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.651 HG13 ' HG2' ' A' ' 13' ' ' ARG . 2.6 p -92.25 -23.62 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.387 -3.615 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -175.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.562 ' HA2' ' HG3' ' A' ' 52' ' ' LYS . . . 93.07 22.85 26.54 Favored Glycine 0 N--CA 1.433 -1.535 0 C-N-CA 120.077 -1.059 . . . . 0.0 111.14 -175.249 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.545 ' HB2' ' CG1' ' A' ' 45' ' ' VAL . 20.1 t80 -78.87 -30.81 45.23 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 177.298 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -76.57 111.75 12.39 Favored 'General case' 0 CA--C 1.483 -1.598 0 N-CA-C 106.096 -1.816 . . . . 0.0 106.096 173.254 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 2.5 p -65.27 -19.72 66.09 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 113.065 0.765 . . . . 0.0 113.065 -175.218 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 42.1 p90 -97.69 -0.47 45.46 Favored 'General case' 0 C--N 1.286 -2.195 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.446 178.463 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.432 ' OD1' ' HG2' ' A' ' 54' ' ' GLN . 20.4 t0 -141.63 91.9 2.41 Favored 'General case' 0 CA--C 1.491 -1.318 0 C-N-CA 118.738 -1.185 . . . . 0.0 111.208 -176.593 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.562 ' HG3' ' HA2' ' A' ' 46' ' ' GLY . 0.1 OUTLIER -121.77 18.86 11.07 Favored 'General case' 0 C--N 1.291 -1.939 0 CA-C-O 121.639 0.733 . . . . 0.0 110.541 175.836 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -78.91 -33.36 45.59 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 176.525 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.484 ' HB3' HG11 ' A' ' 60' ' ' VAL . 7.8 mm-40 -81.76 -3.85 54.86 Favored 'General case' 0 N--CA 1.42 -1.973 0 CA-C-N 113.854 -1.521 . . . . 0.0 110.863 -177.139 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' MET . . . . . 0.57 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 46.6 ttm -62.63 114.83 3.8 Favored 'General case' 0 N--CA 1.421 -1.918 0 C-N-CA 123.115 0.566 . . . . 0.0 111.149 -177.785 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.01 5.66 89.47 Favored Glycine 0 N--CA 1.434 -1.481 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.994 179.301 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -81.38 141.18 34.22 Favored 'General case' 0 CA--C 1.496 -1.122 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 -177.386 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.554 ' O ' ' HD2' ' A' ' 61' ' ' TYR . 11.9 pt20 -78.72 -20.34 50.28 Favored 'General case' 0 C--N 1.277 -2.567 0 CA-C-N 114.926 -1.033 . . . . 0.0 109.332 177.835 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -58.18 -29.97 66.06 Favored 'General case' 0 CA--C 1.497 -1.082 0 CA-C-O 121.939 0.876 . . . . 0.0 111.064 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.688 HG23 ' HB2' ' A' ' 44' ' ' TYR . 21.7 m -115.29 2.3 8.04 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.998 0 CA-C-N 114.744 -1.116 . . . . 0.0 112.253 -171.297 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.554 ' HD2' ' O ' ' A' ' 58' ' ' GLN . 1.8 p90 -54.51 116.68 11.36 Favored Pre-proline 0 C--N 1.306 -1.307 0 O-C-N 124.373 1.045 . . . . 0.0 111.594 -175.819 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 61' ' ' TYR . 9.0 Cg_endo -87.92 109.17 0.63 Allowed 'Trans proline' 0 N--CA 1.426 -2.469 0 C-N-CA 122.763 2.309 . . . . 0.0 109.833 176.456 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -74.28 -141.19 0.65 Allowed Glycine 0 C--N 1.283 -2.38 0 CA-C-N 114.662 -1.154 . . . . 0.0 113.023 177.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.64 129.16 33.57 Favored 'Trans proline' 0 C--O 1.24 0.584 0 C-N-CA 123.04 2.493 . . . . 0.0 113.346 -176.592 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.584 HD11 ' HB3' ' A' ' 100' ' ' LEU . 47.6 mt -65.55 114.17 2.71 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.067 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.469 -178.719 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -108.36 127.53 53.96 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-O 120.775 0.321 . . . . 0.0 110.502 178.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 18.6 m-80 -113.09 6.37 17.56 Favored 'General case' 0 C--N 1.302 -1.487 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.396 -176.693 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 12.1 t -53.8 -32.99 54.63 Favored 'General case' 0 CA--C 1.557 1.233 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 -174.355 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -73.96 -14.79 79.99 Favored Glycine 0 CA--C 1.525 0.691 0 C-N-CA 121.202 -0.523 . . . . 0.0 112.703 -179.275 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 61.6 mt -89.67 -15.56 32.37 Favored 'General case' 0 C--O 1.243 0.755 0 CA-C-O 121.949 0.881 . . . . 0.0 109.273 -179.451 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.633 ' HA ' ' HA ' ' A' ' 79' ' ' LEU . 74.9 mt -86.45 161.44 18.63 Favored 'General case' 0 C--N 1.292 -1.929 0 CA-C-N 114.863 -1.062 . . . . 0.0 112.065 -173.005 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt -92.12 -172.65 3.2 Favored 'General case' 0 C--N 1.308 -1.199 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 178.443 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -94.2 106.83 18.8 Favored 'General case' 0 C--N 1.291 -1.97 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 175.213 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 165.46 -96.12 0.13 Allowed Glycine 0 N--CA 1.433 -1.531 0 N-CA-C 111.383 -0.687 . . . . 0.0 111.383 -177.331 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -112.04 168.23 9.77 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 179.55 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.491 ' HA ' HD13 ' A' ' 71' ' ' LEU . . . -86.99 5.64 36.32 Favored 'General case' 0 C--N 1.305 -1.367 0 CA-C-O 122.135 0.969 . . . . 0.0 110.969 -176.824 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 -114.82 -1.95 13.07 Favored 'General case' 0 C--N 1.286 -2.18 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 178.212 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.8 m -93.87 107.01 18.95 Favored 'General case' 0 C--N 1.296 -1.76 0 CA-C-N 114.247 -1.342 . . . . 0.0 108.541 -177.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.633 ' HA ' ' HA ' ' A' ' 71' ' ' LEU . 1.5 pp -107.91 154.76 21.13 Favored 'General case' 0 C--N 1.292 -1.925 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.433 -174.886 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.473 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 50.3 mtmt -66.27 112.38 3.95 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 122.052 0.929 . . . . 0.0 111.007 179.194 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -60.12 -27.85 67.38 Favored 'General case' 0 C--N 1.298 -1.656 0 C-N-CA 124.979 1.312 . . . . 0.0 112.781 -173.029 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 33.0 m170 -91.96 11.58 24.62 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 112.43 0.53 . . . . 0.0 112.43 -175.672 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 80' ' ' LYS . 61.5 mt -77.36 133.95 38.59 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-O 121.007 0.432 . . . . 0.0 111.266 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 42.8 mt -81.0 164.15 3.11 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.179 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 177.788 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.742 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 5.3 p-10 -64.39 -110.87 0.0 OUTLIER 'General case' 0 C--O 1.19 -2.079 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -176.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -44.11 -29.67 0.65 Allowed 'General case' 0 CA--C 1.557 1.232 0 C-N-CA 127.946 2.498 . . . . 0.0 113.466 -177.658 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 22.9 mt -72.57 -57.59 4.03 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.283 -178.721 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -86.55 -29.45 22.65 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.637 -176.044 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' TYR . . . . . 0.742 ' CE1' ' HA ' ' A' ' 85' ' ' ASP . 7.8 p90 -155.94 -163.06 1.41 Allowed 'General case' 0 C--O 1.194 -1.853 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 -175.386 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.547 ' HB ' ' CG1' ' A' ' 33' ' ' VAL . 0.6 OUTLIER -136.74 148.48 26.79 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.085 0 N-CA-C 106.673 -1.603 . . . . 0.0 106.673 167.138 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.55 HD21 ' CD1' ' A' ' 32' ' ' LEU . 15.9 mt -107.33 123.49 48.42 Favored 'General case' 1 N--CA 1.367 -4.612 0 O-C-N 124.55 1.156 . . . . 0.0 109.24 169.688 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.464 HD13 HD23 ' A' ' 100' ' ' LEU . 12.0 mt -118.12 146.87 40.25 Favored Pre-proline 0 C--N 1.283 -2.318 0 N-CA-C 106.315 -1.735 . . . . 0.0 106.315 -178.098 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -71.17 169.56 20.34 Favored 'Trans proline' 0 C--O 1.259 1.574 0 C-N-CA 121.974 1.783 . . . . 0.0 108.109 176.157 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.593 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 98.6 m -38.96 -52.2 1.79 Allowed 'General case' 0 CA--C 1.543 0.675 0 O-C-N 123.991 0.807 . . . . 0.0 111.707 178.082 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -72.66 -30.95 64.71 Favored 'General case' 0 CA--C 1.498 -1.021 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 -175.824 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.614 ' O ' HD22 ' A' ' 100' ' ' LEU . . . -62.75 -55.05 29.21 Favored Glycine 0 N--CA 1.43 -1.722 0 N-CA-C 109.158 -1.577 . . . . 0.0 109.158 178.102 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.446 ' HB2' ' HB2' ' A' ' 31' ' ' TYR . 68.5 t-105 -58.79 -49.82 76.25 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 123.752 0.821 . . . . 0.0 110.047 178.777 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.593 ' HB2' ' O ' ' A' ' 94' ' ' THR . 5.9 t-20 -48.52 -44.33 36.05 Favored 'General case' 0 C--O 1.207 -1.174 0 C-N-CA 124.909 1.283 . . . . 0.0 110.11 179.096 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -66.84 -51.82 51.03 Favored 'General case' 0 N--CA 1.423 -1.797 0 CA-C-O 119.16 -0.447 . . . . 0.0 111.458 178.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.614 HD22 ' O ' ' A' ' 96' ' ' GLY . 0.4 OUTLIER -59.47 -34.51 72.64 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 121.396 0.617 . . . . 0.0 112.071 179.929 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.507 ' HA ' ' HA ' ' A' ' 105' ' ' THR . 24.0 t -78.0 -27.34 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.378 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.969 178.183 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 73.8 m -78.87 -32.08 45.79 Favored 'General case' 0 C--N 1.291 -1.969 0 O-C-N 121.08 -1.013 . . . . 0.0 109.022 176.424 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' TRP . . . . . 0.471 ' CD1' ' HB1' ' A' ' 6' ' ' ALA . 50.6 m0 -79.88 -49.78 11.43 Favored 'General case' 0 N--CA 1.423 -1.792 0 CA-C-N 115.428 -0.805 . . . . 0.0 112.316 -177.772 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -129.92 5.06 4.96 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -175.318 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.507 ' HA ' ' HA ' ' A' ' 101' ' ' VAL 0.321 13.6 t 49.63 -176.5 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 123.876 1.798 . . . . 0.0 115.268 -176.926 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.426 HD13 ' CH2' ' A' ' 97' ' ' TRP . 37.0 tp -104.56 156.33 18.05 Favored 'General case' 1 C--N 1.23 -4.623 0 CA-C-N 112.022 -2.354 . . . . 0.0 107.251 -175.982 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 32.6 tpp -69.38 132.58 46.6 Favored 'General case' 1 N--CA 1.366 -4.633 0 CA-C-O 122.353 1.073 . . . . 0.0 110.294 178.559 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -63.92 136.87 57.72 Favored 'General case' 0 C--N 1.251 -3.677 0 CA-C-N 112.29 -2.232 . . . . 0.0 111.15 -176.093 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 93.64 -18.04 57.31 Favored Glycine 0 N--CA 1.416 -2.684 0 CA-C-N 114.99 -1.005 . . . . 0.0 112.533 179.7 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -113.88 127.33 55.94 Favored 'General case' 1 N--CA 1.362 -4.866 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 -179.581 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 -98.36 153.32 38.08 Favored Pre-proline 0 C--N 1.301 -1.536 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 -179.518 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_exo -48.49 129.36 19.66 Favored 'Trans proline' 0 CA--C 1.485 -1.953 0 C-N-CA 124.397 3.398 . . . . 0.0 115.985 -174.395 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.44 ' N ' HD12 ' A' ' 113' ' ' ILE . 3.1 mp -92.4 108.95 20.83 Favored 'Isoleucine or valine' 0 N--CA 1.384 -3.732 0 CA-C-N 111.796 -2.456 . . . . 0.0 105.764 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.406 ' HB1' ' CG2' ' A' ' 29' ' ' THR . . . -118.6 149.89 40.6 Favored 'General case' 0 C--N 1.292 -1.901 0 N-CA-C 114.02 1.119 . . . . 0.0 114.02 -173.864 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 81.8 mtt180 -135.61 167.1 21.74 Favored 'General case' 0 CA--C 1.47 -2.113 0 C-N-CA 125.873 1.669 . . . . 0.0 107.121 172.181 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -101.33 176.02 5.38 Favored 'General case' 0 C--N 1.262 -3.234 0 C-N-CA 118.536 -1.266 . . . . 0.0 110.902 179.424 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.626 HG11 ' O ' ' A' ' 25' ' ' ARG . 48.3 t -47.99 134.73 4.91 Favored 'Isoleucine or valine' 0 C--O 1.241 0.625 0 CA-C-O 122.687 1.232 . . . . 0.0 112.495 -176.166 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 2.7 m -104.87 178.79 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.268 -2.949 0 CA-C-N 112.511 -2.131 . . . . 0.0 109.472 -175.559 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -91.28 -28.02 18.05 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -175.4 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 . . . . . 0 N--CA 1.478 0.968 0 C-N-CA 124.743 1.217 . . . . 0.0 113.721 -174.236 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.6 mtt . . . . . 0 CA--C 1.507 -0.678 0 N-CA-C 109.635 -0.505 . . . . 0.0 109.635 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -83.08 135.84 34.69 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.449 -178.603 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -122.15 169.32 11.0 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.778 -178.397 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 92.55 -34.35 4.53 Favored Glycine 0 C--N 1.31 -0.877 0 C-N-CA 121.513 -0.375 . . . . 0.0 113.475 176.103 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 83.37 -91.92 1.63 Allowed Glycine 0 N--CA 1.436 -1.338 0 N-CA-C 109.986 -1.246 . . . . 0.0 109.986 -177.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -136.05 169.22 17.95 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 177.299 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.488 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . -87.06 163.06 17.24 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-O 121.371 0.605 . . . . 0.0 111.34 -179.006 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.652 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 13.3 t70 -64.19 143.06 58.17 Favored 'General case' 0 CA--C 1.48 -1.724 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.072 171.353 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -40.3 -56.83 1.88 Allowed 'General case' 0 C--N 1.299 -1.595 0 C-N-CA 126.422 1.889 . . . . 0.0 112.407 176.569 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -73.66 -25.66 60.37 Favored 'General case' 0 C--N 1.27 -2.879 0 CA-C-N 114.682 -1.144 . . . . 0.0 110.771 -174.535 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.526 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 2.2 m -68.31 -44.98 74.19 Favored 'General case' 0 N--CA 1.398 -3.064 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 175.553 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.652 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 75.1 mt-30 -55.41 -61.62 2.22 Favored 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 123.761 0.825 . . . . 0.0 112.484 -175.751 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.477 ' HB3' HG13 ' A' ' 45' ' ' VAL . 1.4 ptm180 -51.23 -41.56 60.4 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 121.373 0.606 . . . . 0.0 112.32 179.125 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.6 m -72.53 -44.25 62.43 Favored 'General case' 0 C--N 1.291 -1.954 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.792 -176.395 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -76.04 -19.6 58.49 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.144 -174.406 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.607 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 27.4 mm -87.71 -31.07 5.71 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.159 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.024 176.242 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.466 ' O ' ' HG3' ' A' ' 21' ' ' LYS . . . -59.36 -35.09 73.24 Favored 'General case' 0 CA--C 1.498 -1.029 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 -177.828 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 7.3 m -53.8 -53.32 54.04 Favored 'General case' 0 N--CA 1.415 -2.181 0 C-N-CA 126.506 1.922 . . . . 0.0 111.048 176.715 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.657 ' HB3' ' HD2' ' A' ' 93' ' ' PRO . 1.6 mm? -72.1 -15.23 62.0 Favored 'General case' 1 N--CA 1.356 -5.141 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 179.951 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.607 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 11.9 mt -86.03 -24.1 26.53 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-O 121.929 0.871 . . . . 0.0 109.617 177.824 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.466 ' HG3' ' O ' ' A' ' 17' ' ' ALA . 0.1 OUTLIER -90.9 -4.12 56.79 Favored 'General case' 0 CA--C 1.5 -0.98 0 CA-C-O 122.33 1.062 . . . . 0.0 111.521 -174.25 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 32.0 m -90.07 141.44 28.67 Favored 'General case' 0 N--CA 1.389 -3.49 0 CA-C-N 113.557 -1.656 . . . . 0.0 111.048 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.1 m -108.62 166.26 10.93 Favored 'General case' 0 N--CA 1.399 -2.977 0 CA-C-N 113.734 -1.575 . . . . 0.0 110.743 178.667 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.512 HD13 ' H ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -108.06 167.03 10.28 Favored 'General case' 1 N--CA 1.36 -4.936 0 CA-C-N 113.121 -1.854 . . . . 0.0 114.111 -170.897 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.645 ' O ' HG21 ' A' ' 117' ' ' VAL . 0.0 OUTLIER -126.83 159.86 32.63 Favored 'General case' 0 C--N 1.261 -3.251 0 CA-C-N 111.423 -2.626 . . . . 0.0 104.873 -178.821 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -67.6 132.6 47.85 Favored 'General case' 0 C--N 1.289 -2.063 0 CA-C-N 117.939 0.336 . . . . 0.0 110.983 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 99.01 -2.7 58.21 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.864 -0.684 . . . . 0.0 113.559 176.799 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.564 ' OD2' ' HB2' ' A' ' 25' ' ' ARG . 8.3 m-20 -86.77 155.51 20.3 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 117.18 0.49 . . . . 0.0 112.179 -177.672 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.428 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 41.3 m -108.67 136.56 48.04 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.3 -178.692 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.475 ' CZ2' HD12 ' A' ' 24' ' ' LEU . 36.4 m95 -122.46 153.89 38.53 Favored 'General case' 0 N--CA 1.429 -1.515 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 176.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -106.56 129.35 54.52 Favored 'General case' 0 C--N 1.273 -2.729 0 CA-C-O 120.992 0.425 . . . . 0.0 110.246 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.665 HD11 ' CG ' ' A' ' 89' ' ' TYR . 27.1 tp -90.0 128.98 36.38 Favored 'General case' 1 N--CA 1.367 -4.625 0 CA-C-N 114.335 -1.302 . . . . 0.0 113.039 -177.229 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.403 HG12 ' O ' ' A' ' 34' ' ' ASP . 55.3 t -118.09 139.77 44.02 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.012 0 C-N-CA 126.111 1.765 . . . . 0.0 108.743 -178.646 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.587 ' OD2' ' HB2' ' A' ' 36' ' ' ARG . 10.9 t70 -64.73 123.53 19.58 Favored 'General case' 0 C--N 1.299 -1.615 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 169.812 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.4 t -65.6 -27.55 68.49 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 120.989 0.423 . . . . 0.0 109.883 -172.564 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.587 ' HB2' ' OD2' ' A' ' 34' ' ' ASP . 67.8 mtt85 -66.95 -34.95 78.9 Favored 'General case' 0 C--O 1.243 0.752 0 C-N-CA 123.459 0.704 . . . . 0.0 110.236 -177.608 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 69.7 t90 -71.34 -46.25 60.99 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 175.684 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 30.3 t80 -58.6 -41.44 85.83 Favored 'General case' 0 CA--C 1.549 0.937 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.979 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.575 ' O ' ' HG3' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -51.32 -48.87 62.23 Favored 'General case' 0 CA--C 1.489 -1.395 0 CA-C-N 118.231 0.468 . . . . 0.0 111.178 173.075 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.406 ' HG3' ' O ' ' A' ' 60' ' ' VAL . 5.7 tp-100 -60.12 -43.92 95.29 Favored 'General case' 0 N--CA 1.409 -2.498 0 O-C-N 123.796 0.685 . . . . 0.0 110.634 -177.101 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 76.5 t90 -61.07 -39.99 91.97 Favored 'General case' 0 C--O 1.214 -0.77 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.451 178.526 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.508 ' HD3' ' HA ' ' A' ' 39' ' ' LYS . 14.4 mtpp -60.1 -41.0 91.57 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-O 120.927 0.394 . . . . 0.0 111.742 -178.494 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.575 ' HG3' ' O ' ' A' ' 39' ' ' LYS . 18.3 mtpp -73.57 -39.06 64.94 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 -175.316 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.688 ' HB2' HG23 ' A' ' 60' ' ' VAL . 0.2 OUTLIER -67.41 -44.34 79.03 Favored 'General case' 0 N--CA 1.428 -1.543 0 CA-C-N 114.173 -1.376 . . . . 0.0 111.205 -179.654 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.477 HG13 ' HB3' ' A' ' 13' ' ' ARG . 2.3 p -85.14 -12.34 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.608 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.323 -174.85 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 66.33 43.15 93.39 Favored Glycine 0 N--CA 1.44 -1.086 0 N-CA-C 109.879 -1.288 . . . . 0.0 109.879 -175.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.466 ' HB2' ' CG1' ' A' ' 45' ' ' VAL . 88.2 t80 -64.82 -40.51 95.32 Favored 'General case' 0 N--CA 1.437 -1.111 0 C-N-CA 123.802 0.841 . . . . 0.0 108.976 -179.039 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.462 ' O ' ' HB2' ' A' ' 52' ' ' LYS . 7.4 m-20 -95.64 132.74 40.48 Favored 'General case' 0 C--N 1.298 -1.639 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 179.253 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.2 m -69.11 -22.44 63.97 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-O 121.488 0.661 . . . . 0.0 111.982 -179.465 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 38.7 p90 -99.3 2.3 45.34 Favored 'General case' 0 C--N 1.302 -1.489 0 C-N-CA 123.512 0.725 . . . . 0.0 110.379 -177.651 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.499 ' OD2' ' HG2' ' A' ' 43' ' ' LYS . 14.9 t70 -150.18 73.15 1.14 Allowed 'General case' 0 CA--C 1.472 -2.03 0 N-CA-C 103.608 -2.738 . . . . 0.0 103.608 -176.634 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 48' ' ' ASP 0.386 53.4 tptt -142.57 13.89 1.95 Allowed 'General case' 0 N--CA 1.393 -3.3 0 CA-C-N 110.661 -2.972 . . . . 0.0 109.237 -157.733 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 59.7 m-85 -99.36 -13.28 19.67 Favored 'General case' 0 C--N 1.293 -1.88 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.435 -173.332 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.545 ' HB3' HG11 ' A' ' 60' ' ' VAL . 43.0 mt-30 -97.94 6.98 47.08 Favored 'General case' 0 N--CA 1.426 -1.644 0 N-CA-C 107.961 -1.125 . . . . 0.0 107.961 176.605 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' MET . . . . . 0.526 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 56.7 ttp -63.63 116.02 5.27 Favored 'General case' 0 N--CA 1.412 -2.352 0 CA-C-N 114.795 -1.093 . . . . 0.0 109.848 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.73 18.26 75.73 Favored Glycine 0 N--CA 1.429 -1.796 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.612 -179.192 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.59 ' HB3' HG22 ' A' ' 60' ' ' VAL . 9.3 t0 -94.34 143.95 25.96 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 179.313 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.451 ' O ' ' HD2' ' A' ' 61' ' ' TYR . 13.7 pt20 -84.3 -15.79 45.37 Favored 'General case' 0 C--N 1.291 -1.95 0 CA-C-O 122.007 0.908 . . . . 0.0 110.647 -179.198 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 -64.71 -28.06 69.34 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-N 114.659 -1.155 . . . . 0.0 111.217 177.819 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.688 HG23 ' HB2' ' A' ' 44' ' ' TYR . 33.2 m -115.65 1.82 8.12 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.099 0 CA-C-N 114.952 -1.022 . . . . 0.0 112.089 -172.038 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.451 ' HD2' ' O ' ' A' ' 58' ' ' GLN . 0.8 OUTLIER -64.87 118.13 45.68 Favored Pre-proline 0 C--N 1.307 -1.266 0 C-N-CA 119.638 -0.825 . . . . 0.0 109.696 -178.988 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 61' ' ' TYR . 18.4 Cg_endo -87.46 113.8 0.95 Allowed 'Trans proline' 0 N--CA 1.412 -3.282 0 C-N-CA 122.429 2.086 . . . . 0.0 109.828 177.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -73.26 -134.35 0.23 Allowed Glycine 0 C--N 1.275 -2.816 0 CA-C-N 114.233 -1.348 . . . . 0.0 112.105 177.115 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -56.65 131.06 43.31 Favored 'Trans proline' 0 CA--C 1.502 -1.108 0 C-N-CA 122.518 2.146 . . . . 0.0 112.357 -177.243 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.528 ' O ' HD23 ' A' ' 106' ' ' LEU . 96.2 mt -58.56 112.44 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.551 0 CA-C-N 114.365 -1.288 . . . . 0.0 109.505 177.185 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -106.86 103.45 12.89 Favored 'General case' 0 C--N 1.288 -2.095 0 N-CA-C 107.073 -1.455 . . . . 0.0 107.073 178.11 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.535 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 90.3 m-20 -90.74 6.22 45.0 Favored 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.818 173.844 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.8 m -54.13 -29.95 47.06 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.583 1.153 . . . . 0.0 111.971 -177.751 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -64.94 -25.16 70.58 Favored Glycine 0 CA--C 1.523 0.589 0 C-N-CA 121.59 -0.338 . . . . 0.0 112.295 178.444 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 72.8 mt -92.22 -23.03 19.48 Favored 'General case' 0 CA--C 1.496 -1.097 0 CA-C-O 120.816 0.341 . . . . 0.0 110.198 179.099 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 67' ' ' ASN . 21.5 mt -78.94 152.18 31.24 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.788 -172.418 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 72.9 mttt -60.02 168.18 1.98 Allowed 'General case' 0 N--CA 1.422 -1.875 0 CA-C-O 122.981 1.372 . . . . 0.0 114.589 177.013 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -89.09 83.43 6.54 Favored 'General case' 0 C--N 1.282 -2.343 0 CA-C-N 113.051 -1.886 . . . . 0.0 108.716 -178.518 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 137.38 -59.3 0.63 Allowed Glycine 0 N--CA 1.431 -1.665 0 CA-C-N 114.649 -1.16 . . . . 0.0 110.909 -178.292 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -92.32 123.51 35.71 Favored 'General case' 0 CA--C 1.508 -0.664 0 CA-C-O 120.896 0.379 . . . . 0.0 110.907 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -92.95 14.43 17.64 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 121.813 0.816 . . . . 0.0 110.1 179.605 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 15.2 mm-40 -119.69 7.24 11.02 Favored 'General case' 0 C--N 1.28 -2.431 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 -178.258 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 50.0 m -132.7 134.27 44.57 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 114.197 -1.365 . . . . 0.0 111.917 -173.837 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.9 mt -78.64 157.74 28.59 Favored 'General case' 0 C--N 1.315 -0.93 0 O-C-N 123.499 0.499 . . . . 0.0 109.731 175.807 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -72.89 158.47 35.44 Favored 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 173.054 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -90.06 -3.92 57.67 Favored 'General case' 0 C--N 1.293 -1.862 0 CA-C-O 121.075 0.464 . . . . 0.0 111.249 -178.47 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -99.25 11.37 39.25 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -177.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 32.6 mt -84.24 166.82 17.2 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-O 121.854 0.835 . . . . 0.0 113.162 -170.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.627 HG21 HD12 ' A' ' 87' ' ' LEU . 53.8 mt -142.23 173.61 7.21 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 N-CA-C 105.14 -2.17 . . . . 0.0 105.14 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.643 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 25.8 t70 -67.95 -142.03 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.95 0 CA-C-O 117.37 -1.3 . . . . 0.0 110.438 -179.524 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.509 ' HA ' ' O ' ' A' ' 89' ' ' TYR . 9.5 pt-20 -40.53 -18.62 0.01 OUTLIER 'General case' 0 N--CA 1.509 2.503 0 N-CA-C 117.625 2.454 . . . . 0.0 117.625 -173.09 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.627 HD12 HG21 ' A' ' 84' ' ' ILE . 21.0 mt -62.24 -51.57 67.23 Favored 'General case' 0 C--N 1.285 -2.232 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 171.049 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -102.12 -45.82 5.03 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.903 -177.462 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' TYR . . . . . 0.665 ' CG ' HD11 ' A' ' 32' ' ' LEU . 0.9 OUTLIER -140.3 167.89 21.08 Favored 'General case' 0 C--O 1.164 -3.416 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.669 -174.096 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.495 ' O ' HD12 ' A' ' 32' ' ' LEU . 4.3 mt -136.16 146.69 28.77 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.511 0 O-C-N 120.851 -1.156 . . . . 0.0 110.665 178.886 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.461 HD23 ' HA ' ' A' ' 91' ' ' LEU . 64.5 mt -109.04 133.72 52.61 Favored 'General case' 0 C--N 1.291 -1.958 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.761 178.651 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.46 HD12 ' N ' ' A' ' 92' ' ' LEU . 1.0 OUTLIER -140.78 156.13 68.97 Favored Pre-proline 0 C--N 1.289 -2.038 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 -178.54 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.657 ' HD2' ' HB3' ' A' ' 19' ' ' LEU . 39.6 Cg_exo -64.58 168.9 12.19 Favored 'Trans proline' 0 C--O 1.252 1.215 0 C-N-CA 122.975 2.45 . . . . 0.0 111.225 175.789 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.469 HG22 ' ND2' ' A' ' 98' ' ' ASN . 86.9 m -45.62 -47.76 14.73 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 124.421 1.088 . . . . 0.0 109.766 172.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.538 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.1 mp0 -51.8 -54.41 29.07 Favored 'General case' 0 C--O 1.209 -1.027 0 C-N-CA 125.421 1.488 . . . . 0.0 110.689 178.386 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.561 ' O ' HD22 ' A' ' 100' ' ' LEU . . . -54.98 -60.97 7.89 Favored Glycine 0 N--CA 1.43 -1.748 0 O-C-N 124.388 1.055 . . . . 0.0 111.273 -177.533 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.46 ' HZ2' HD11 ' A' ' 106' ' ' LEU . 68.5 t-105 -52.13 -50.22 62.13 Favored 'General case' 0 C--N 1.308 -1.238 0 C-N-CA 124.361 1.064 . . . . 0.0 111.184 178.385 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.469 ' ND2' HG22 ' A' ' 94' ' ' THR . 89.6 m-20 -53.47 -37.21 62.45 Favored 'General case' 0 C--O 1.187 -2.208 0 CA-C-O 118.791 -0.623 . . . . 0.0 111.585 177.74 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.464 ' HG3' ' O ' ' A' ' 95' ' ' GLU . 87.6 mttt -69.56 -50.36 45.57 Favored 'General case' 0 N--CA 1.41 -2.449 0 CA-C-N 118.6 0.636 . . . . 0.0 109.827 -178.868 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.561 HD22 ' O ' ' A' ' 96' ' ' GLY . 0.8 OUTLIER -58.75 -38.49 78.55 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.295 0.569 . . . . 0.0 111.731 178.588 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.414 ' O ' ' HA ' ' A' ' 105' ' ' THR . 37.9 t -74.35 -31.16 27.8 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.931 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.428 178.816 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 57.9 m -72.17 -36.16 69.2 Favored 'General case' 0 N--CA 1.418 -2.071 0 CA-C-O 121.717 0.77 . . . . 0.0 109.512 -179.405 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' TRP . . . . . 0.407 ' CZ2' ' HB3' ' A' ' 99' ' ' LYS . 38.4 m0 -78.57 -51.33 10.08 Favored 'General case' 0 N--CA 1.424 -1.738 0 CA-C-N 114.692 -1.14 . . . . 0.0 111.998 -176.834 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -123.2 4.39 9.21 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 114.558 1.318 . . . . 0.0 114.558 -172.427 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.414 ' HA ' ' O ' ' A' ' 101' ' ' VAL 0.271 22.8 p 54.29 174.87 0.02 OUTLIER 'General case' 0 N--CA 1.413 -2.301 0 N-CA-C 116.089 1.885 . . . . 0.0 116.089 -177.856 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.674 ' CD1' ' HD3' ' A' ' 112' ' ' PRO . 0.5 OUTLIER -98.86 179.88 4.5 Favored 'General case' 0 N--CA 1.407 -2.621 0 CA-C-N 114.961 -1.018 . . . . 0.0 108.308 -179.974 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.619 ' H ' HD23 ' A' ' 106' ' ' LEU . 19.5 ttm -94.95 134.58 37.46 Favored 'General case' 1 N--CA 1.347 -5.621 0 CA-C-O 122.027 0.918 . . . . 0.0 109.846 178.08 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -64.32 123.63 19.65 Favored 'General case' 0 N--CA 1.393 -3.319 0 CA-C-N 113.316 -1.766 . . . . 0.0 111.267 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 112.33 -19.01 22.73 Favored Glycine 0 N--CA 1.405 -3.371 0 C-N-CA 119.911 -1.138 . . . . 0.0 111.626 178.463 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.492 ' HG2' ' O ' ' A' ' 107' ' ' MET . 2.6 pt20 -116.6 164.52 14.48 Favored 'General case' 0 N--CA 1.406 -2.628 0 C-N-CA 119.966 -0.694 . . . . 0.0 109.64 178.435 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -135.94 144.9 50.37 Favored Pre-proline 0 C--N 1.29 -1.985 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.15 -179.224 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' PRO . . . . . 0.674 ' HD3' ' CD1' ' A' ' 106' ' ' LEU . 36.3 Cg_exo -42.7 132.63 5.47 Favored 'Trans proline' 0 CA--C 1.457 -3.327 0 C-N-CA 125.216 3.944 . . . . 0.0 113.427 177.305 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.523 HD11 HD21 ' A' ' 71' ' ' LEU . 3.2 mp -93.11 106.53 18.05 Favored 'Isoleucine or valine' 1 N--CA 1.368 -4.541 0 CA-C-N 113.302 -1.772 . . . . 0.0 106.527 177.73 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.428 ' HB1' ' CG2' ' A' ' 29' ' ' THR . . . -91.08 127.7 36.61 Favored 'General case' 0 N--CA 1.406 -2.649 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 177.53 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 15.2 tpt180 -121.63 129.79 53.05 Favored 'General case' 0 C--N 1.271 -2.817 0 N-CA-C 105.732 -1.951 . . . . 0.0 105.732 -177.745 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? -82.28 168.34 17.7 Favored 'General case' 0 C--N 1.272 -2.793 0 C-N-CA 119.687 -0.805 . . . . 0.0 109.014 176.476 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.645 HG21 ' O ' ' A' ' 25' ' ' ARG . 65.4 t -51.51 141.5 4.87 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-O 122.03 0.919 . . . . 0.0 111.157 -178.904 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 17.2 m -79.6 178.13 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.403 -2.814 0 CA-C-N 113.987 -1.46 . . . . 0.0 114.389 -169.011 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -89.11 -1.2 57.99 Favored 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 114.059 -1.428 . . . . 0.0 111.408 -176.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 . . . . . 0 C--N 1.307 -1.28 0 CA-C-O 119.096 -0.478 . . . . 0.0 109.761 -177.95 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.526 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . . . . . . 0 N--CA 1.441 -0.876 0 CA-C-O 120.301 0.096 . . . . 0.0 110.877 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.671 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 10.9 t70 -70.2 151.53 45.27 Favored 'General case' 0 CA--C 1.482 -1.658 0 N-CA-C 107.403 -1.332 . . . . 0.0 107.403 173.322 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 19.0 mt -60.25 -38.06 82.32 Favored 'General case' 0 C--N 1.305 -1.334 0 CA-C-O 121.083 0.468 . . . . 0.0 110.887 -175.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -62.14 -31.45 71.93 Favored 'General case' 0 N--CA 1.488 1.473 0 CA-C-N 114.463 -1.244 . . . . 0.0 108.485 -178.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.585 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 3.9 m -80.01 -49.77 11.34 Favored 'General case' 1 N--CA 1.371 -4.395 0 CA-C-N 113.427 -1.715 . . . . 0.0 110.682 178.291 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.671 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 60.0 mt-30 -51.61 -61.54 2.19 Favored 'General case' 0 C--N 1.347 0.487 0 C-N-CA 123.096 0.558 . . . . 0.0 112.085 -174.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.494 ' HA ' ' CH2' ' A' ' 41' ' ' TRP . 6.8 ppt_? -57.74 -38.84 76.04 Favored 'General case' 0 C--O 1.208 -1.109 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -179.255 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.3 t -77.75 -36.8 50.35 Favored 'General case' 0 C--N 1.282 -2.337 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.549 -175.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.486 ' O ' ' HB ' ' A' ' 18' ' ' THR . 9.8 t70 -70.29 -41.39 73.42 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.464 0.65 . . . . 0.0 109.632 -177.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.567 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 44.7 mm -71.27 -31.89 45.4 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.906 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.306 178.28 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.99 -30.73 71.14 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.978 0.894 . . . . 0.0 108.695 177.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.499 ' HA ' ' HE2' ' A' ' 21' ' ' LYS . 1.0 OUTLIER -71.59 -25.96 62.4 Favored 'General case' 0 N--CA 1.4 -2.96 0 CA-C-N 114.198 -1.365 . . . . 0.0 110.488 178.179 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.519 ' HB3' ' CG ' ' A' ' 93' ' ' PRO . 76.6 mt -85.2 -17.54 36.8 Favored 'General case' 0 C--N 1.282 -2.349 0 CA-C-O 121.038 0.447 . . . . 0.0 111.311 -177.268 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.567 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 12.3 mt -86.11 -26.71 25.1 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 -179.328 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.499 ' HE2' ' HA ' ' A' ' 18' ' ' THR . 0.0 OUTLIER -91.72 -5.34 53.83 Favored 'General case' 0 N--CA 1.432 -1.333 0 CA-C-N 114.458 -1.246 . . . . 0.0 110.344 177.692 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.447 ' HB ' ' HA ' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -76.43 138.82 40.58 Favored 'General case' 0 N--CA 1.415 -2.182 0 CA-C-N 113.2 -1.818 . . . . 0.0 110.868 178.727 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 71.2 m -57.56 142.96 42.77 Favored 'General case' 0 C--N 1.283 -2.318 0 CA-C-N 113.086 -1.87 . . . . 0.0 111.699 179.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.651 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP 0.296 0.5 OUTLIER -91.33 -27.07 18.62 Favored 'General case' 0 CA--C 1.465 -2.324 0 N-CA-C 116.743 2.127 . . . . 0.0 116.743 -175.315 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.511 ' O ' HG21 ' A' ' 117' ' ' VAL . 0.0 OUTLIER 63.67 112.01 0.03 OUTLIER 'General case' 0 C--N 1.249 -3.789 0 C-N-CA 127.782 2.433 . . . . 0.0 111.899 179.144 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -60.95 113.04 2.31 Favored 'General case' 0 C--N 1.292 -1.92 0 CA-C-O 121.233 0.539 . . . . 0.0 111.972 -177.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 103.16 7.57 43.3 Favored Glycine 0 N--CA 1.437 -1.29 0 CA-C-N 115.074 -0.966 . . . . 0.0 112.3 -177.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.478 ' HB2' ' HB2' ' A' ' 25' ' ' ARG . 4.8 t70 -87.39 -177.7 6.0 Favored 'General case' 0 C--O 1.248 1.013 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.473 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 40.3 m -126.74 118.06 23.95 Favored 'General case' 0 N--CA 1.424 -1.773 0 CA-C-O 121.427 0.632 . . . . 0.0 110.285 -176.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.651 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 18.2 m95 -107.01 164.72 11.9 Favored 'General case' 0 C--N 1.288 -2.084 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 178.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.415 ' O ' ' HA ' ' A' ' 91' ' ' LEU . 86.7 m-85 -122.43 137.51 54.84 Favored 'General case' 0 C--N 1.278 -2.501 0 N-CA-C 110.329 -0.249 . . . . 0.0 110.329 -178.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.46 ' CD1' ' HB2' ' A' ' 115' ' ' ARG . 9.5 mp -78.74 152.3 31.6 Favored 'General case' 0 C--N 1.309 -1.171 0 C-N-CA 120.275 -0.57 . . . . 0.0 111.626 178.586 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.5 HG12 ' O ' ' A' ' 34' ' ' ASP . 7.2 t -137.75 142.06 37.33 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.624 0 N-CA-C 105.691 -1.966 . . . . 0.0 105.691 172.208 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.5 ' O ' HG12 ' A' ' 33' ' ' VAL . 3.7 p-10 -71.05 141.12 50.9 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 173.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 33.5 p -69.48 -22.21 63.64 Favored 'General case' 0 C--N 1.285 -2.202 0 C-N-CA 120.404 -0.518 . . . . 0.0 111.814 -173.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 90.9 mtt180 -73.37 -40.58 64.25 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.005 -173.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.437 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 71.7 t90 -63.66 -48.05 78.79 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 108.28 -1.008 . . . . 0.0 108.28 178.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.535 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 32.6 t80 -63.29 -43.61 97.38 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-N 114.793 -1.094 . . . . 0.0 110.802 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.471 ' HA ' ' HE2' ' A' ' 42' ' ' LYS . 94.7 mttt -63.02 -34.12 76.88 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 176.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.437 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 17.7 tp60 -65.35 -43.87 89.51 Favored 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 172.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.494 ' CH2' ' HA ' ' A' ' 13' ' ' ARG . 65.6 t90 -58.94 -41.97 88.67 Favored 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 114.778 -1.101 . . . . 0.0 110.872 177.609 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.535 ' HG3' ' O ' ' A' ' 38' ' ' PHE . 40.4 mtmt -54.02 -41.89 68.51 Favored 'General case' 0 CA--C 1.507 -0.708 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 179.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -63.41 -49.31 74.28 Favored 'General case' 0 CA--C 1.504 -0.819 0 O-C-N 124.111 0.882 . . . . 0.0 109.89 178.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.592 ' HB2' HG23 ' A' ' 60' ' ' VAL . 0.1 OUTLIER -66.08 -41.4 90.73 Favored 'General case' 0 N--CA 1.427 -1.619 0 CA-C-N 114.257 -1.338 . . . . 0.0 112.003 -173.792 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.434 HG12 ' O ' ' A' ' 41' ' ' TRP . 5.7 p -90.36 -21.23 6.71 Favored 'Isoleucine or valine' 0 N--CA 1.395 -3.178 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.513 -174.269 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.638 ' HA2' ' HG3' ' A' ' 52' ' ' LYS . . . 84.78 33.05 19.9 Favored Glycine 0 N--CA 1.418 -2.51 0 C-N-CA 120.32 -0.943 . . . . 0.0 111.162 -175.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.419 ' HB3' ' HA ' ' A' ' 42' ' ' LYS . 49.9 t80 -74.67 -41.3 60.54 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -88.25 121.36 30.56 Favored 'General case' 0 C--N 1.311 -1.077 0 N-CA-C 107.144 -1.428 . . . . 0.0 107.144 -178.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 31.6 m -60.13 -15.82 26.99 Favored 'General case' 0 C--N 1.297 -1.709 0 N-CA-C 117.323 2.342 . . . . 0.0 117.323 -168.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 63.6 p-90 -104.07 -9.47 18.75 Favored 'General case' 0 N--CA 1.379 -3.986 0 CA-C-N 120.484 1.493 . . . . 0.0 107.67 -177.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -122.13 73.5 1.1 Allowed 'General case' 0 N--CA 1.423 -1.78 0 CA-C-N 114.954 -1.021 . . . . 0.0 109.844 -165.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.638 ' HG3' ' HA2' ' A' ' 46' ' ' GLY . 0.0 OUTLIER -121.5 28.29 7.8 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.179 177.829 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -81.81 -26.34 34.43 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 175.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.611 ' HB3' HG11 ' A' ' 60' ' ' VAL . 11.2 mm100 -97.83 0.94 47.67 Favored 'General case' 0 N--CA 1.413 -2.298 0 CA-C-N 114.35 -1.295 . . . . 0.0 109.995 -178.151 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . 0.424 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 14.3 tmm? -64.95 116.97 6.93 Favored 'General case' 0 N--CA 1.414 -2.252 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.608 -177.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 83.36 3.85 89.77 Favored Glycine 0 N--CA 1.431 -1.692 0 CA-C-N 114.468 -1.242 . . . . 0.0 111.692 -179.193 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.598 ' HB3' HG22 ' A' ' 60' ' ' VAL . 5.5 t0 -82.07 147.1 29.3 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 -176.408 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -84.33 -22.3 30.65 Favored 'General case' 0 C--N 1.296 -1.751 0 CA-C-O 121.347 0.594 . . . . 0.0 110.64 -178.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -60.8 -31.77 71.14 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 121.925 0.869 . . . . 0.0 110.783 -179.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.611 HG11 ' HB3' ' A' ' 54' ' ' GLN . 27.9 m -105.99 8.49 9.66 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.123 0 CA-C-N 114.457 -1.247 . . . . 0.0 111.881 -172.729 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -60.12 119.04 38.51 Favored Pre-proline 0 C--N 1.304 -1.41 0 O-C-N 124.258 0.974 . . . . 0.0 109.349 179.326 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_endo -88.07 112.9 0.77 Allowed 'Trans proline' 0 N--CA 1.415 -3.113 0 C-N-CA 122.385 2.057 . . . . 0.0 108.905 174.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -68.7 -139.47 0.08 OUTLIER Glycine 0 C--N 1.288 -2.138 0 CA-C-N 114.926 -1.034 . . . . 0.0 112.56 176.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.46 ' HA ' ' O ' ' A' ' 104' ' ' TYR . 28.7 Cg_exo -64.32 137.42 55.85 Favored 'Trans proline' 0 C--O 1.248 0.988 0 C-N-CA 122.075 1.85 . . . . 0.0 112.048 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 65.2 mt -60.01 124.15 13.82 Favored 'Isoleucine or valine' 0 C--O 1.242 0.685 0 C-N-CA 123.389 0.676 . . . . 0.0 110.345 -178.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -116.58 104.56 11.53 Favored 'General case' 0 CA--C 1.501 -0.934 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -172.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.617 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 45.6 m-80 -95.0 12.43 28.47 Favored 'General case' 0 C--N 1.295 -1.778 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.567 -176.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 49.6 m -56.55 -34.7 67.35 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -177.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -72.26 -16.15 77.04 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 121.506 -0.378 . . . . 0.0 112.404 178.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 48.0 mt -93.28 -31.52 14.67 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 178.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.617 ' HG ' ' O ' ' A' ' 67' ' ' ASN . 70.0 mt -76.45 146.02 38.87 Favored 'General case' 0 N--CA 1.433 -1.286 0 CA-C-N 114.65 -1.159 . . . . 0.0 110.646 -176.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 62.8 mttt . . . . . 0 C--N 1.301 -1.501 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 -177.821 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.444 ' HA ' HD13 ' A' ' 71' ' ' LEU . . . . . . . . 0 CA--C 1.508 -0.648 0 CA-C-O 121.925 0.869 . . . . 0.0 110.028 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 6.8 mm100 -117.04 5.58 12.83 Favored 'General case' 0 C--N 1.285 -2.203 0 CA-C-O 122.147 0.975 . . . . 0.0 108.791 -174.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 35.8 m -122.65 125.07 44.88 Favored 'General case' 0 C--N 1.281 -2.381 0 CA-C-N 114.007 -1.451 . . . . 0.0 109.75 -176.538 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.432 HD22 ' N ' ' A' ' 79' ' ' LEU . 2.4 mm? -85.02 151.1 24.42 Favored 'General case' 0 N--CA 1.428 -1.531 0 C-N-CA 123.361 0.664 . . . . 0.0 110.241 178.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.537 ' HB2' ' CD1' ' A' ' 83' ' ' LEU . 99.2 mttt -76.92 168.13 20.62 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-O 121.285 0.564 . . . . 0.0 111.377 176.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -74.25 -45.91 44.86 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 114.678 1.362 . . . . 0.0 114.678 -172.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 26.4 m-70 -81.3 -0.16 39.71 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -167.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.55 ' HB3' ' CE2' ' A' ' 89' ' ' TYR . 8.9 mp -57.3 133.02 54.76 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -179.56 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.676 HG21 HD12 ' A' ' 87' ' ' LEU . 49.5 mt -129.82 174.53 12.46 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.379 0 N-CA-C 104.926 -2.25 . . . . 0.0 104.926 177.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.463 ' N ' HG22 ' A' ' 84' ' ' ILE . 62.4 t0 -57.12 -151.82 0.0 OUTLIER 'General case' 0 CA--C 1.594 2.657 0 C-N-CA 126.58 1.952 . . . . 0.0 110.412 179.167 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.722 ' HA ' ' O ' ' A' ' 89' ' ' TYR 0.322 0.0 OUTLIER -39.24 -17.81 0.01 OUTLIER 'General case' 1 N--CA 1.545 4.321 0 N-CA-C 117.884 2.55 . . . . 0.0 117.884 -172.558 . . . . . . . . 5 4 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.676 HD12 HG21 ' A' ' 84' ' ' ILE . 31.5 mt -60.8 -46.26 91.18 Favored 'General case' 0 C--N 1.278 -2.531 0 C-N-CA 124.683 1.193 . . . . 0.0 110.112 171.143 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -114.69 -45.8 2.98 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-O 121.407 0.623 . . . . 0.0 109.452 -178.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' TYR . . . . . 0.722 ' O ' ' HA ' ' A' ' 86' ' ' GLU . 2.0 p90 -138.27 -169.45 2.59 Favored 'General case' 1 C--O 1.139 -4.72 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 -176.114 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.423 HD13 HG21 ' A' ' 90' ' ' ILE . 8.6 mt -149.05 162.85 4.68 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.903 0 N-CA-C 106.03 -1.841 . . . . 0.0 106.03 173.357 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.451 HD13 ' HA ' ' A' ' 32' ' ' LEU . 2.5 mm? -120.12 147.41 44.91 Favored 'General case' 0 N--CA 1.404 -2.77 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 172.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -124.38 153.53 69.05 Favored Pre-proline 0 C--N 1.271 -2.811 0 CA-C-N 114.616 -1.175 . . . . 0.0 108.689 171.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.519 ' CG ' ' HB3' ' A' ' 19' ' ' LEU . 5.3 Cg_endo -63.24 168.18 11.44 Favored 'Trans proline' 0 N--CA 1.432 -2.107 0 N-CA-C 107.668 -1.705 . . . . 0.0 107.668 167.063 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 14.7 m -44.36 -48.14 9.72 Favored 'General case' 0 C--N 1.298 -1.652 0 O-C-N 123.743 0.652 . . . . 0.0 110.93 175.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -67.13 -38.92 86.41 Favored 'General case' 0 CA--C 1.472 -2.054 0 CA-C-N 115.052 -0.976 . . . . 0.0 112.086 -177.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.521 ' O ' ' HG ' ' A' ' 100' ' ' LEU . . . -63.86 -51.08 56.54 Favored Glycine 0 N--CA 1.405 -3.37 0 C-N-CA 120.575 -0.821 . . . . 0.0 111.129 -176.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 63.5 t-105 -59.7 -48.98 79.51 Favored 'General case' 0 C--N 1.292 -1.913 0 CA-C-N 114.198 -1.001 . . . . 0.0 110.273 175.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 -51.52 -38.49 54.36 Favored 'General case' 0 C--O 1.195 -1.79 0 O-C-N 123.389 0.43 . . . . 0.0 111.641 176.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 28.3 mttm -66.03 -50.4 64.33 Favored 'General case' 0 CA--C 1.47 -2.109 0 CA-C-O 121.239 0.542 . . . . 0.0 110.308 -179.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' A' ' 96' ' ' GLY . 67.1 mt -67.61 -31.84 72.14 Favored 'General case' 0 C--N 1.275 -2.66 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.765 -176.116 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.548 ' HA ' ' HA ' ' A' ' 105' ' ' THR . 25.0 t -80.28 -24.83 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.398 -3.032 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.017 175.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 20.4 t -78.24 -35.05 48.8 Favored 'General case' 0 C--N 1.299 -1.626 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 178.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' TRP . . . . . 0.459 ' CE3' HD23 ' A' ' 100' ' ' LEU . 34.7 m0 -82.99 -48.87 10.18 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.311 -177.395 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' TYR . . . . . 0.46 ' O ' ' HA ' ' A' ' 64' ' ' PRO . 60.9 m-85 -130.54 6.74 4.82 Favored 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 -173.159 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.548 ' HA ' ' HA ' ' A' ' 101' ' ' VAL 0.27 11.1 t 48.24 -173.27 0.01 OUTLIER 'General case' 0 C--O 1.236 0.389 0 CA-C-O 123.895 1.807 . . . . 0.0 115.13 -179.71 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -105.15 151.81 23.59 Favored 'General case' 1 C--N 1.236 -4.353 0 CA-C-N 112.213 -2.267 . . . . 0.0 105.724 -174.232 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 54.4 mmm -64.14 155.96 29.95 Favored 'General case' 0 CA--C 1.495 -1.146 0 CA-C-O 121.855 0.836 . . . . 0.0 111.627 175.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 20.1 pm0 -75.15 137.88 41.65 Favored 'General case' 0 N--CA 1.389 -3.5 0 CA-C-N 114.346 -1.297 . . . . 0.0 109.289 178.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 89.72 4.12 73.27 Favored Glycine 0 N--CA 1.422 -2.244 0 CA-C-N 114.999 -1.001 . . . . 0.0 112.267 179.353 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -120.48 169.17 10.58 Favored 'General case' 0 CA--C 1.482 -1.636 0 CA-C-O 121.689 0.756 . . . . 0.0 111.634 -178.45 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -137.76 158.87 70.83 Favored Pre-proline 0 N--CA 1.412 -2.325 0 CA-C-N 114.013 -1.449 . . . . 0.0 107.091 178.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_exo -67.14 134.49 34.15 Favored 'Trans proline' 0 CA--C 1.459 -3.253 0 C-N-CA 122.705 2.27 . . . . 0.0 111.255 175.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 3.7 mp -94.76 107.03 18.87 Favored 'Isoleucine or valine' 1 N--CA 1.377 -4.121 0 CA-C-N 113.654 -1.612 . . . . 0.0 106.97 176.646 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . 0.473 ' HB1' ' CG2' ' A' ' 29' ' ' THR . . . -94.02 128.4 40.36 Favored 'General case' 0 N--CA 1.41 -2.452 0 CA-C-O 121.94 0.876 . . . . 0.0 111.124 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.46 ' HB2' ' CD1' ' A' ' 32' ' ' LEU . 17.0 tpt180 -119.69 120.5 36.8 Favored 'General case' 0 C--N 1.28 -2.43 0 CA-C-N 113.909 -1.496 . . . . 0.0 108.085 -175.682 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -67.81 155.94 38.19 Favored 'General case' 0 N--CA 1.424 -1.741 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 172.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.511 HG21 ' O ' ' A' ' 25' ' ' ARG . 90.8 t . . . . . 0 C--N 1.297 -1.699 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 175.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.341 0 CA-C-O 121.494 0.664 . . . . 0.0 112.484 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.666 ' O ' ' HB ' ' A' ' 11' ' ' THR . 0.6 OUTLIER -62.43 140.07 58.57 Favored 'General case' 0 C--O 1.207 -1.138 0 CA-C-N 114.842 -1.072 . . . . 0.0 108.811 170.298 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.507 ' O ' ' HG3' ' A' ' 13' ' ' ARG . 16.9 mt -61.08 -42.32 98.28 Favored 'General case' 0 CA--C 1.489 -1.4 0 CA-C-O 121.68 0.752 . . . . 0.0 110.77 -174.354 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -64.99 -23.67 67.29 Favored 'General case' 0 C--N 1.292 -1.91 0 CA-C-N 114.424 -1.262 . . . . 0.0 109.464 -177.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.666 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 2.6 m -78.42 -51.65 9.73 Favored 'General case' 0 N--CA 1.389 -3.497 0 CA-C-N 114.722 -1.126 . . . . 0.0 109.761 174.153 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.643 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 52.0 mt-30 -51.58 -53.77 34.57 Favored 'General case' 0 C--N 1.353 0.733 0 C-N-CA 123.528 0.731 . . . . 0.0 111.492 -175.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.547 ' HG2' HG13 ' A' ' 45' ' ' VAL . 45.1 mtm180 -45.06 -58.21 3.35 Favored 'General case' 0 N--CA 1.486 1.374 0 CA-C-O 121.942 0.877 . . . . 0.0 110.598 177.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 74.3 m -66.68 -45.96 77.19 Favored 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 113.735 -1.575 . . . . 0.0 112.769 -172.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.5 t0 -66.28 -39.57 89.49 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.977 -176.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.594 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 26.2 mm -76.07 -37.88 34.03 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.353 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.268 178.36 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.548 ' O ' ' HG2' ' A' ' 21' ' ' LYS . . . -57.79 -39.87 78.53 Favored 'General case' 0 CA--C 1.495 -1.156 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.435 ' HA ' ' HD3' ' A' ' 21' ' ' LYS . 5.7 m -60.22 -36.28 77.34 Favored 'General case' 0 N--CA 1.396 -3.143 0 CA-C-N 113.372 -1.74 . . . . 0.0 112.015 179.401 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.464 ' HB3' ' CG ' ' A' ' 93' ' ' PRO . 71.8 mt -85.65 -13.33 48.92 Favored 'General case' 0 C--N 1.269 -2.918 0 O-C-N 121.611 -0.68 . . . . 0.0 112.495 -176.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.594 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 16.2 mt -86.04 -25.25 26.02 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 177.101 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.548 ' HG2' ' O ' ' A' ' 17' ' ' ALA . 19.6 ptmt -91.42 -22.11 20.62 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.596 -176.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 16.4 m -51.06 134.95 25.98 Favored 'General case' 0 N--CA 1.402 -2.839 0 C-N-CA 125.204 1.402 . . . . 0.0 111.639 174.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 72.8 m -77.47 149.59 35.02 Favored 'General case' 0 N--CA 1.395 -3.2 0 CA-C-N 113.529 -1.669 . . . . 0.0 111.649 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -111.44 168.01 9.87 Favored 'General case' 0 N--CA 1.41 -2.44 0 CA-C-N 115.275 -0.875 . . . . 0.0 112.158 178.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.406 ' O ' HG21 ' A' ' 117' ' ' VAL . 0.0 OUTLIER -143.32 152.26 41.44 Favored 'General case' 0 C--N 1.281 -2.393 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 175.743 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -55.08 128.55 34.23 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 121.094 0.474 . . . . 0.0 110.858 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 113.3 -18.3 20.96 Favored Glycine 0 N--CA 1.424 -2.142 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.533 -177.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -72.28 141.15 48.9 Favored 'General case' 0 CA--C 1.498 -1.023 0 CA-C-N 117.288 0.544 . . . . 0.0 110.637 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 49.0 m -97.59 134.34 40.93 Favored 'General case' 0 C--N 1.294 -1.806 0 N-CA-C 107.448 -1.315 . . . . 0.0 107.448 175.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.425 ' HB3' ' HB3' ' A' ' 91' ' ' LEU . 39.3 m95 -120.12 137.04 54.38 Favored 'General case' 0 C--N 1.282 -2.364 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 179.662 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 67.6 m-85 -98.24 121.66 40.44 Favored 'General case' 0 C--N 1.264 -3.132 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.041 -176.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.782 HD11 ' CD1' ' A' ' 89' ' ' TYR . 15.9 tp -81.07 138.96 35.96 Favored 'General case' 0 N--CA 1.4 -2.933 0 CA-C-N 115.114 -0.948 . . . . 0.0 113.348 -178.588 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.494 HG12 ' O ' ' A' ' 34' ' ' ASP . 58.4 t -132.8 150.67 33.28 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.128 0 C-N-CA 126.126 1.77 . . . . 0.0 107.285 -177.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.684 ' HB2' HD21 ' A' ' 70' ' ' LEU . 6.8 t70 -72.16 136.86 46.61 Favored 'General case' 0 C--N 1.284 -2.264 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 169.553 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.418 ' OG ' ' HE3' ' A' ' 39' ' ' LYS . 29.1 t -68.8 -31.58 70.68 Favored 'General case' 0 C--N 1.3 -1.586 0 CA-C-O 121.028 0.442 . . . . 0.0 111.177 -174.804 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.431 ' HB2' ' OD2' ' A' ' 34' ' ' ASP . 55.7 mtt180 -69.66 -34.16 73.61 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.373 -175.073 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.494 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 76.5 t90 -67.5 -45.48 75.69 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 177.405 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.447 ' CG ' HD12 ' A' ' 90' ' ' ILE . 23.7 t80 -65.18 -39.69 93.24 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.112 -179.203 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.43 ' HA ' ' HD3' ' A' ' 42' ' ' LYS . 98.4 mttt -64.64 -33.68 76.52 Favored 'General case' 0 CA--C 1.506 -0.723 0 CA-C-O 120.898 0.38 . . . . 0.0 111.511 175.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.494 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 24.5 tp60 -64.42 -44.54 90.92 Favored 'General case' 0 N--CA 1.408 -2.571 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 175.6 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 65.1 t90 -60.76 -43.4 98.04 Favored 'General case' 0 C--O 1.217 -0.633 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.396 176.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.594 ' HG2' ' CD1' ' A' ' 47' ' ' PHE . 15.3 mtpp -57.35 -39.29 75.62 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 123.153 0.581 . . . . 0.0 112.109 -178.204 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 40.3 mttp -72.97 -40.29 65.43 Favored 'General case' 0 C--N 1.285 -2.211 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 177.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.606 ' HB2' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -68.76 -38.15 79.88 Favored 'General case' 0 C--N 1.289 -2.049 0 CA-C-N 114.861 -1.063 . . . . 0.0 110.142 -176.956 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.547 HG13 ' HG2' ' A' ' 13' ' ' ARG . 4.3 p -88.79 -17.84 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.626 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.499 -176.258 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.42 ' HA2' ' CB ' ' A' ' 52' ' ' LYS . . . 83.07 27.96 38.95 Favored Glycine 0 N--CA 1.438 -1.227 0 C-N-CA 120.418 -0.896 . . . . 0.0 112.138 -174.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.594 ' CD1' ' HG2' ' A' ' 42' ' ' LYS . 48.8 t80 -72.73 -38.3 67.46 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 176.171 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.461 ' HB2' ' O ' ' A' ' 51' ' ' ASP . 71.4 m-20 -73.82 111.2 8.74 Favored 'General case' 0 CA--C 1.491 -1.289 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 174.213 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 11.0 m -60.95 -37.23 81.66 Favored 'General case' 0 C--N 1.297 -1.677 0 CA-C-O 121.573 0.701 . . . . 0.0 109.694 178.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 49.2 p90 -81.74 -15.55 53.97 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 114.912 -1.04 . . . . 0.0 111.336 -179.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.461 ' O ' ' HB2' ' A' ' 48' ' ' ASP . 7.6 t70 -141.13 86.87 2.06 Favored 'General case' 0 CA--C 1.475 -1.932 0 CA-C-O 122.364 1.078 . . . . 0.0 110.82 -175.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.42 ' CB ' ' HA2' ' A' ' 46' ' ' GLY . 63.7 pttt -142.33 18.77 2.07 Favored 'General case' 0 C--N 1.28 -2.427 0 CA-C-N 113.95 -1.477 . . . . 0.0 110.225 -179.295 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -60.55 -28.43 68.43 Favored 'General case' 0 C--N 1.292 -1.894 0 CA-C-N 112.747 -2.024 . . . . 0.0 107.355 172.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -94.8 11.92 29.82 Favored 'General case' 0 N--CA 1.421 -1.898 0 CA-C-N 113.958 -1.474 . . . . 0.0 111.661 -174.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . 0.498 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 43.8 ttm -59.46 113.04 1.99 Allowed 'General case' 0 N--CA 1.429 -1.503 0 CA-C-O 121.013 0.435 . . . . 0.0 111.059 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.38 4.78 90.04 Favored Glycine 0 N--CA 1.437 -1.296 0 CA-C-N 115.393 -0.821 . . . . 0.0 112.569 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.574 ' HB3' HG22 ' A' ' 60' ' ' VAL . 4.8 t70 -76.46 148.99 36.86 Favored 'General case' 0 CA--C 1.509 -0.596 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 -176.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -83.7 -14.59 51.34 Favored 'General case' 0 C--N 1.299 -1.592 0 CA-C-O 122.117 0.96 . . . . 0.0 109.618 -178.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 33.2 m-80 -65.34 -25.98 67.83 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.551 175.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.606 HG23 ' HB2' ' A' ' 44' ' ' TYR . 34.1 m -119.9 3.19 6.87 Favored 'Isoleucine or valine' 0 CA--C 1.476 -1.871 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -172.354 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.457 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 5.3 p90 -62.43 118.11 37.36 Favored Pre-proline 0 C--N 1.308 -1.228 0 C-N-CA 119.334 -0.946 . . . . 0.0 109.291 178.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 61' ' ' TYR . 10.1 Cg_endo -88.63 111.04 0.6 Allowed 'Trans proline' 0 N--CA 1.418 -2.936 0 C-N-CA 122.397 2.065 . . . . 0.0 110.088 177.48 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -69.66 -153.9 0.88 Allowed Glycine 0 C--N 1.285 -2.286 0 CA-C-N 115.081 -0.963 . . . . 0.0 112.066 175.249 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.511 ' HB2' ' SD ' ' A' ' 107' ' ' MET . 88.6 Cg_exo -51.38 137.61 47.48 Favored 'Trans proline' 0 C--O 1.252 1.183 0 C-N-CA 122.929 2.419 . . . . 0.0 113.031 -179.721 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.424 HG12 ' CZ2' ' A' ' 37' ' ' TRP . 45.9 mt -64.18 110.51 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.012 0 CA-C-N 114.498 -1.228 . . . . 0.0 111.196 -175.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.532 ' HB2' ' HG3' ' A' ' 107' ' ' MET . 17.5 t70 -104.4 115.64 30.73 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.182 177.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -111.53 24.07 13.21 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.778 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 30.2 m -70.59 9.03 0.7 Allowed 'General case' 0 CA--C 1.554 1.133 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 -177.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -109.89 -4.97 29.47 Favored Glycine 0 CA--C 1.496 -1.105 0 C-N-CA 119.14 -1.505 . . . . 0.0 109.782 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.684 HD21 ' HB2' ' A' ' 34' ' ' ASP . 2.2 mm? -98.46 -52.99 3.46 Favored 'General case' 0 N--CA 1.418 -2.026 0 CA-C-N 113.482 -1.359 . . . . 0.0 109.797 -176.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.57 ' HA ' ' HA ' ' A' ' 79' ' ' LEU . 78.7 mt -59.86 147.13 39.5 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.224 -1.353 . . . . 0.0 113.842 -175.521 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.9 mtpt . . . . . 0 N--CA 1.429 -1.518 0 CA-C-N 113.98 -1.463 . . . . 0.0 108.968 176.319 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.887 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . 0.544 HE22 ' HB2' ' A' ' 111' ' ' GLU . 23.5 mm-40 -125.03 5.46 7.94 Favored 'General case' 0 CA--C 1.478 -1.8 0 N-CA-C 106.601 -1.629 . . . . 0.0 106.601 177.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.7 m -131.54 122.16 25.66 Favored 'General case' 0 C--N 1.28 -2.446 0 CA-C-N 112.594 -2.094 . . . . 0.0 109.061 -172.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.577 ' HG ' ' CD2' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -103.64 163.31 12.4 Favored 'General case' 0 N--CA 1.423 -1.814 0 O-C-N 123.451 0.469 . . . . 0.0 109.931 176.023 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.484 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 49.2 mtmt -60.59 116.5 4.4 Favored 'General case' 0 C--N 1.293 -1.85 0 CA-C-O 122.116 0.96 . . . . 0.0 111.802 -177.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.413 ' H ' ' CD ' ' A' ' 81' ' ' GLU . 1.2 pm0 -64.39 -8.99 15.22 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 115.027 1.492 . . . . 0.0 115.027 -172.776 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 46.0 m-70 -98.22 0.29 45.51 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 122.135 -0.353 . . . . 0.0 111.491 178.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.484 ' HG ' ' O ' ' A' ' 80' ' ' LYS . 56.6 mt -77.09 133.28 39.08 Favored 'General case' 0 C--O 1.248 1.026 0 CA-C-O 121.178 0.513 . . . . 0.0 109.808 179.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.62 HG21 HD12 ' A' ' 87' ' ' LEU . 49.2 mt -89.0 171.3 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.615 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 178.573 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.645 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 19.3 t70 -59.64 -139.52 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.971 0 C-N-CA 125.953 1.701 . . . . 0.0 111.041 -179.312 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.607 ' HA ' ' O ' ' A' ' 89' ' ' TYR . 0.1 OUTLIER -41.44 -18.82 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.565 0 N-CA-C 117.231 2.308 . . . . 0.0 117.231 -174.204 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.62 HD12 HG21 ' A' ' 84' ' ' ILE . 35.8 mt -60.96 -50.78 72.02 Favored 'General case' 0 C--N 1.292 -1.934 0 CA-C-O 121.57 0.7 . . . . 0.0 109.702 171.588 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -105.51 -45.79 4.35 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.794 -179.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' TYR . . . . . 0.782 ' CD1' HD11 ' A' ' 32' ' ' LEU . 1.5 p90 -139.09 -176.79 4.63 Favored 'General case' 0 C--O 1.161 -3.564 0 CA-C-O 119.323 -0.37 . . . . 0.0 110.703 -175.544 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.447 HD12 ' CG ' ' A' ' 38' ' ' PHE . 5.4 mt -143.48 151.53 16.8 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.472 0 CA-C-N 119.493 1.042 . . . . 0.0 109.329 176.334 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.498 HD23 ' HA ' ' A' ' 32' ' ' LEU . 64.2 mt -112.67 133.82 54.5 Favored 'General case' 0 N--CA 1.4 -2.961 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.268 175.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.464 HD11 HG21 ' A' ' 33' ' ' VAL . 56.0 mt -121.09 150.77 54.24 Favored Pre-proline 0 C--N 1.281 -2.404 0 CA-C-N 113.744 -1.571 . . . . 0.0 107.366 -178.419 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.464 ' CG ' ' HB3' ' A' ' 19' ' ' LEU . 72.2 Cg_endo -76.21 169.12 22.66 Favored 'Trans proline' 0 N--CA 1.429 -2.27 0 N-CA-C 107.902 -1.615 . . . . 0.0 107.902 172.508 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 58.1 m -38.25 -54.71 1.39 Allowed 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 123.999 0.92 . . . . 0.0 112.988 177.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -71.56 -32.44 68.11 Favored 'General case' 0 CA--C 1.498 -1.025 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -175.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.442 ' O ' ' HG ' ' A' ' 100' ' ' LEU . . . -59.03 -47.69 89.57 Favored Glycine 0 N--CA 1.436 -1.353 0 N-CA-C 109.99 -1.244 . . . . 0.0 109.99 177.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 69.1 t-105 -67.8 -50.05 58.98 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 123.512 0.725 . . . . 0.0 110.114 178.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -53.3 -31.29 43.26 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 179.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 39.7 mttm -68.39 -55.43 12.0 Favored 'General case' 0 CA--C 1.468 -2.206 0 C-N-CA 123.172 0.589 . . . . 0.0 110.309 176.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.481 HD23 ' CE3' ' A' ' 103' ' ' TRP . 80.9 mt -64.32 -32.83 74.59 Favored 'General case' 0 C--N 1.275 -2.635 0 CA-C-N 114.885 -1.052 . . . . 0.0 112.196 -176.076 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.404 ' O ' ' HA ' ' A' ' 105' ' ' THR . 10.3 t -78.02 -25.87 14.41 Favored 'Isoleucine or valine' 0 N--CA 1.401 -2.89 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.247 175.096 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 14.7 t -81.38 -33.87 32.03 Favored 'General case' 0 C--N 1.295 -1.787 0 O-C-N 121.425 -0.797 . . . . 0.0 109.086 178.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' TRP . . . . . 0.481 ' CE3' HD23 ' A' ' 100' ' ' LEU . 50.3 m0 -79.93 -45.04 19.25 Favored 'General case' 0 N--CA 1.429 -1.489 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.426 -178.118 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 33.5 m-85 -128.99 -4.05 5.09 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 115.241 1.571 . . . . 0.0 115.241 -174.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.404 ' HA ' ' O ' ' A' ' 101' ' ' VAL 0.279 7.9 p 58.3 167.28 0.05 OUTLIER 'General case' 0 N--CA 1.42 -1.931 0 N-CA-C 116.211 1.93 . . . . 0.0 116.211 -174.941 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 30.2 tp -92.4 157.24 16.7 Favored 'General case' 0 C--N 1.281 -2.411 0 CA-C-N 114.09 -1.414 . . . . 0.0 107.438 176.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . 0.532 ' HG3' ' HB2' ' A' ' 66' ' ' ASP . 62.8 mmm -74.17 156.37 37.39 Favored 'General case' 0 CA--C 1.49 -1.352 0 CA-C-O 121.775 0.798 . . . . 0.0 110.428 174.553 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -89.32 153.56 20.78 Favored 'General case' 0 N--CA 1.394 -3.242 0 CA-C-N 114.32 -1.309 . . . . 0.0 109.2 -179.037 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 101.41 -29.97 11.39 Favored Glycine 0 N--CA 1.415 -2.719 0 C-N-CA 119.873 -1.156 . . . . 0.0 110.965 -176.563 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -117.14 177.09 4.84 Favored 'General case' 0 N--CA 1.421 -1.904 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . 0.544 ' HB2' HE22 ' A' ' 77' ' ' GLN . 49.1 mt-10 -135.09 160.31 68.77 Favored Pre-proline 0 C--N 1.298 -1.661 0 N-CA-C 106.925 -1.509 . . . . 0.0 106.925 -178.36 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -55.99 122.66 12.16 Favored 'Trans proline' 0 CA--C 1.459 -3.256 0 C-N-CA 122.723 2.282 . . . . 0.0 111.054 177.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.416 ' HB ' ' HB3' ' A' ' 32' ' ' LEU . 33.8 mt -79.63 105.93 9.9 Favored 'Isoleucine or valine' 1 N--CA 1.379 -4.002 0 CA-C-N 113.05 -1.887 . . . . 0.0 106.957 -179.375 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -98.22 129.97 44.95 Favored 'General case' 0 C--N 1.266 -3.065 0 CA-C-O 121.913 0.863 . . . . 0.0 110.767 -178.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.541 ' NE ' ' HA ' ' A' ' 115' ' ' ARG . 4.0 mmp_? -124.33 -174.47 3.02 Favored 'General case' 0 N--CA 1.395 -3.209 0 N-CA-C 105.111 -2.181 . . . . 0.0 105.111 176.552 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 61.3 pttt -153.01 173.85 14.9 Favored 'General case' 0 C--N 1.254 -3.566 0 C-N-CA 119.822 -0.751 . . . . 0.0 109.658 -177.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.406 HG21 ' O ' ' A' ' 25' ' ' ARG . 21.4 t . . . . . 0 C--N 1.295 -1.791 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 172.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.466 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . . . . . . 0 CA--C 1.506 -0.742 0 CA-C-O 120.652 0.263 . . . . 0.0 110.525 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.66 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 15.0 t70 -67.4 145.47 55.02 Favored 'General case' 0 CA--C 1.483 -1.605 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 175.199 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.407 ' O ' ' HG2' ' A' ' 13' ' ' ARG . 38.1 mt -55.07 -41.79 71.96 Favored 'General case' 0 CA--C 1.494 -1.18 0 CA-C-N 119.03 0.832 . . . . 0.0 110.234 -177.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -69.0 -35.9 77.22 Favored 'General case' 0 CA--C 1.494 -1.206 0 CA-C-N 114.461 -1.245 . . . . 0.0 109.989 -177.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.5 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 5.4 m -65.2 -52.37 55.15 Favored 'General case' 0 N--CA 1.389 -3.522 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.028 177.042 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.66 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 79.1 mt-30 -49.31 -54.07 18.84 Favored 'General case' 0 CA--C 1.504 -0.806 0 C-N-CA 124.444 1.097 . . . . 0.0 111.934 -177.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.407 ' HG2' ' O ' ' A' ' 9' ' ' LEU . 10.7 ptt180 -64.01 -43.46 95.55 Favored 'General case' 0 N--CA 1.434 -1.256 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.646 -174.29 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 44.7 m -69.27 -44.52 71.71 Favored 'General case' 0 C--N 1.288 -2.07 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.244 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -63.81 -37.54 87.75 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.023 0.929 . . . . 0.0 109.962 -175.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.529 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 34.7 mm -78.97 -37.45 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.164 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.299 177.8 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.72 -36.71 77.11 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 -178.146 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 1.3 m -62.48 -32.95 73.93 Favored 'General case' 0 N--CA 1.412 -2.353 0 C-N-CA 124.786 1.234 . . . . 0.0 111.757 177.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 69.0 mt -85.86 -14.01 46.24 Favored 'General case' 0 C--N 1.278 -2.53 0 O-C-N 121.251 -0.906 . . . . 0.0 111.7 -177.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 14.3 mt -84.67 -26.13 27.99 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 177.113 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.406 ' H ' ' HG3' ' A' ' 21' ' ' LYS . 0.1 OUTLIER -91.39 -13.95 31.51 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-O 122.275 1.036 . . . . 0.0 111.348 -176.859 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 5.6 m -72.33 145.06 48.05 Favored 'General case' 0 N--CA 1.402 -2.869 0 CA-C-N 113.67 -1.604 . . . . 0.0 109.386 173.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.7 t -100.58 161.68 13.44 Favored 'General case' 0 N--CA 1.401 -2.891 0 CA-C-O 121.7 0.762 . . . . 0.0 110.628 -176.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.651 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP . 0.5 OUTLIER -99.46 167.68 10.46 Favored 'General case' 0 C--N 1.294 -1.826 0 CA-C-N 114.57 -1.196 . . . . 0.0 112.829 179.782 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -104.88 -157.45 0.61 Allowed 'General case' 0 C--N 1.291 -1.948 0 N-CA-C 105.939 -1.874 . . . . 0.0 105.939 176.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.46 ' C ' HG21 ' A' ' 117' ' ' VAL . 16.1 ptpt -119.39 29.98 7.35 Favored 'General case' 0 N--CA 1.414 -2.259 0 CA-C-O 121.478 0.656 . . . . 0.0 110.352 172.095 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.502 ' N ' HG21 ' A' ' 117' ' ' VAL . . . -149.78 20.34 1.14 Allowed Glycine 0 CA--C 1.54 1.618 0 CA-C-N 114.831 -1.077 . . . . 0.0 114.165 176.223 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.441 ' H ' HG11 ' A' ' 117' ' ' VAL . 10.9 m-20 -96.15 -174.48 3.1 Favored 'General case' 0 N--CA 1.491 1.588 0 CA-C-N 118.544 1.172 . . . . 0.0 110.055 -178.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.405 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 90.1 m -133.71 127.44 32.84 Favored 'General case' 0 N--CA 1.425 -1.698 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 170.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.651 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 17.1 m95 -114.33 163.72 14.9 Favored 'General case' 0 C--N 1.277 -2.584 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.453 ' HB2' ' HB2' ' A' ' 97' ' ' TRP . 89.1 m-85 -123.46 141.87 51.57 Favored 'General case' 0 C--N 1.278 -2.505 0 C-N-CA 121.069 -0.252 . . . . 0.0 111.507 -175.605 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.618 HD13 HG22 ' A' ' 113' ' ' ILE . 5.5 mp -92.04 134.64 34.63 Favored 'General case' 0 CA--C 1.461 -2.452 0 O-C-N 124.54 1.15 . . . . 0.0 111.512 -179.71 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.438 HG12 ' O ' ' A' ' 34' ' ' ASP . 95.8 t -116.52 142.65 29.21 Favored 'Isoleucine or valine' 0 C--N 1.251 -3.69 0 N-CA-C 102.932 -2.988 . . . . 0.0 102.932 171.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.438 ' O ' HG12 ' A' ' 33' ' ' VAL . 10.2 p-10 -72.75 136.7 45.55 Favored 'General case' 0 C--N 1.278 -2.541 0 N-CA-C 106.897 -1.52 . . . . 0.0 106.897 174.004 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 61.9 p -62.3 -28.36 69.68 Favored 'General case' 0 C--N 1.272 -2.802 0 CA-C-N 114.278 -1.328 . . . . 0.0 110.024 -173.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.9 mmt85 -69.96 -45.78 66.67 Favored 'General case' 0 N--CA 1.423 -1.824 0 CA-C-N 114.02 -1.446 . . . . 0.0 110.058 -173.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.522 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 69.1 t90 -67.61 -44.19 78.65 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 179.36 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.446 ' CG ' HD12 ' A' ' 90' ' ' ILE . 38.4 t80 -61.86 -37.83 85.99 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.185 -178.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -73.78 -23.66 59.73 Favored 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 121.693 -0.629 . . . . 0.0 112.627 178.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.522 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 24.5 tp60 -70.29 -42.61 71.84 Favored 'General case' 0 N--CA 1.412 -2.341 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 172.114 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.447 ' O ' HG22 ' A' ' 45' ' ' VAL . 78.4 t90 -62.31 -39.39 92.88 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-N 114.241 -1.345 . . . . 0.0 110.529 176.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.535 ' HG2' ' CD2' ' A' ' 47' ' ' PHE . 11.5 mtpp -55.57 -46.77 77.16 Favored 'General case' 0 CA--C 1.498 -1.032 0 C-N-CA 123.265 0.626 . . . . 0.0 111.683 178.475 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -57.66 -52.5 65.19 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 124.766 1.291 . . . . 0.0 110.727 178.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.649 ' HB2' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -60.61 -36.42 78.56 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 113.594 -1.639 . . . . 0.0 114.226 -175.241 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.447 HG22 ' O ' ' A' ' 41' ' ' TRP . 18.8 m -95.95 -17.26 6.99 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.781 0 N-CA-C 113.234 0.827 . . . . 0.0 113.234 -178.842 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.568 ' HA2' ' CB ' ' A' ' 52' ' ' LYS . . . 79.79 38.12 20.92 Favored Glycine 0 N--CA 1.4 -3.743 0 C-N-CA 119.949 -1.12 . . . . 0.0 110.967 -172.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.535 ' CD2' ' HG2' ' A' ' 42' ' ' LYS . 75.9 t80 -63.22 -40.43 97.44 Favored 'General case' 0 N--CA 1.442 -0.827 0 C-N-CA 123.022 0.529 . . . . 0.0 111.562 -176.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.663 ' HB3' ' HB3' ' A' ' 51' ' ' ASP . 3.5 t70 -92.3 -178.95 5.09 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 -174.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . 0.463 ' O ' ' HE2' ' A' ' 52' ' ' LYS . 20.8 m -84.94 -37.17 20.85 Favored 'General case' 0 C--N 1.294 -1.822 0 N-CA-C 111.755 0.279 . . . . 0.0 111.755 -176.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 66.7 p-90 -105.13 -21.14 13.32 Favored 'General case' 0 N--CA 1.39 -3.471 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 -178.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.663 ' HB3' ' HB3' ' A' ' 48' ' ' ASP . 31.7 t0 -94.98 73.29 3.46 Favored 'General case' 0 CA--C 1.461 -2.449 0 CA-C-N 114.071 -1.422 . . . . 0.0 108.776 -170.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.568 ' CB ' ' HA2' ' A' ' 46' ' ' GLY . 65.2 pttt -162.39 9.68 0.06 Allowed 'General case' 0 N--CA 1.415 -2.192 0 CA-C-N 112.689 -2.051 . . . . 0.0 114.058 -174.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -63.53 -22.9 67.15 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-O 122.639 1.209 . . . . 0.0 108.101 171.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.472 ' HB3' HG11 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -94.48 11.34 31.13 Favored 'General case' 0 N--CA 1.427 -1.594 0 CA-C-N 113.426 -1.715 . . . . 0.0 110.858 -175.817 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 46.5 ttm -62.11 115.13 3.85 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 110.067 -0.345 . . . . 0.0 110.067 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.03 20.55 77.5 Favored Glycine 0 N--CA 1.44 -1.094 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.824 -179.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.525 ' HB3' HG22 ' A' ' 60' ' ' VAL . 5.7 t0 -91.83 147.6 22.86 Favored 'General case' 0 CA--C 1.503 -0.846 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 -179.302 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.442 ' O ' ' HD2' ' A' ' 61' ' ' TYR . 19.4 pt20 -83.21 -17.56 42.35 Favored 'General case' 0 C--N 1.296 -1.72 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 -62.39 -25.26 67.83 Favored 'General case' 0 CA--C 1.492 -1.27 0 CA-C-N 115.043 -0.981 . . . . 0.0 111.41 177.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.649 HG23 ' HB2' ' A' ' 44' ' ' TYR . 26.5 m -121.19 7.44 6.07 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.824 0 CA-C-N 115.028 -0.987 . . . . 0.0 112.099 -172.401 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.442 ' HD2' ' O ' ' A' ' 58' ' ' GLN . 0.9 OUTLIER -62.73 116.53 24.41 Favored Pre-proline 0 C--N 1.305 -1.342 0 O-C-N 124.052 0.845 . . . . 0.0 111.067 -178.419 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 61' ' ' TYR . 15.0 Cg_endo -89.78 117.97 0.75 Allowed 'Trans proline' 0 N--CA 1.41 -3.399 0 C-N-CA 122.699 2.266 . . . . 0.0 111.422 177.555 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -73.45 -153.67 2.64 Favored Glycine 0 C--N 1.273 -2.95 0 CA-C-N 113.806 -1.543 . . . . 0.0 111.253 171.046 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.4 ' HB2' ' SD ' ' A' ' 107' ' ' MET . 52.3 Cg_exo -55.83 143.06 82.76 Favored 'Trans proline' 0 C--O 1.245 0.859 0 C-N-CA 122.82 2.347 . . . . 0.0 112.662 -178.547 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.444 HD11 ' HB3' ' A' ' 100' ' ' LEU . 42.2 mt -64.95 114.07 2.3 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.115 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.82 -176.768 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.582 ' HB2' ' HG3' ' A' ' 107' ' ' MET . 24.4 t70 -113.35 104.96 12.83 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 116.022 -0.535 . . . . 0.0 109.769 178.687 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -91.22 19.51 5.84 Favored 'General case' 0 C--N 1.303 -1.419 0 CA-C-N 116.925 -0.125 . . . . 0.0 111.245 -176.12 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 33.2 t -54.75 -31.66 58.8 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -176.004 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -66.06 -18.25 66.62 Favored Glycine 0 CA--C 1.527 0.79 0 C-N-CA 121.296 -0.478 . . . . 0.0 113.446 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 32.1 mt -93.61 -21.61 19.3 Favored 'General case' 0 C--O 1.247 0.928 0 CA-C-O 121.395 0.617 . . . . 0.0 109.388 179.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.555 HD13 ' HA ' ' A' ' 76' ' ' ALA . 50.3 mt -79.87 137.6 36.97 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.713 -173.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt . . . . . 0 C--O 1.246 0.891 0 CA-C-O 122.264 1.031 . . . . 0.0 111.135 178.24 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.555 ' HA ' HD13 ' A' ' 71' ' ' LEU . . . . . . . . 0 N--CA 1.438 -1.035 0 CA-C-O 121.939 0.876 . . . . 0.0 109.629 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 23.2 mm-40 -114.94 3.13 14.45 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.238 178.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 94.7 p -98.13 113.04 24.81 Favored 'General case' 0 C--N 1.297 -1.683 0 CA-C-N 115.164 -0.926 . . . . 0.0 111.343 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.593 HD11 HG21 ' A' ' 113' ' ' ILE . 3.0 mm? -93.68 141.87 28.0 Favored 'General case' 0 N--CA 1.425 -1.705 0 C-N-CA 123.867 0.867 . . . . 0.0 111.459 -179.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -61.69 139.27 58.32 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.318 0.58 . . . . 0.0 111.163 175.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.566 ' H ' ' CD ' ' A' ' 81' ' ' GLU . 0.4 OUTLIER -58.56 -48.07 82.11 Favored 'General case' 0 C--N 1.301 -1.501 0 C-N-CA 124.838 1.255 . . . . 0.0 110.139 -176.445 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 71.9 m80 -84.85 12.06 8.11 Favored 'General case' 0 C--N 1.295 -1.793 0 CA-C-N 113.971 -1.468 . . . . 0.0 114.053 -170.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 74.9 mt -60.49 119.59 8.32 Favored 'General case' 0 C--O 1.24 0.604 0 CA-C-O 120.879 0.371 . . . . 0.0 111.965 178.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.74 HG21 HD12 ' A' ' 87' ' ' LEU . 51.2 mt -98.89 171.78 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.434 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 173.514 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.589 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 24.0 t70 -62.87 -139.08 0.0 OUTLIER 'General case' 0 C--O 1.185 -2.292 0 C-N-CA 125.183 1.393 . . . . 0.0 111.497 -177.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.687 ' HA ' ' O ' ' A' ' 89' ' ' TYR 0.271 1.0 OUTLIER -40.72 -20.54 0.01 OUTLIER 'General case' 0 N--CA 1.535 3.799 0 N-CA-C 117.018 2.229 . . . . 0.0 117.018 -173.192 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.74 HD12 HG21 ' A' ' 84' ' ' ILE . 66.1 mt -60.81 -57.98 10.37 Favored 'General case' 0 C--N 1.281 -2.39 0 C-N-CA 124.124 0.97 . . . . 0.0 109.645 171.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.527 ' HB2' ' O ' ' A' ' 84' ' ' ILE . 10.2 m-20 -97.86 -49.21 4.89 Favored 'General case' 0 CA--C 1.491 -1.295 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.06 -178.659 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' TYR . . . . . 0.687 ' O ' ' HA ' ' A' ' 86' ' ' GLU . 5.4 p90 -135.39 -165.87 1.75 Allowed 'General case' 0 C--O 1.16 -3.62 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 -175.214 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.555 ' O ' ' HA ' ' A' ' 32' ' ' LEU . 9.0 mt -147.05 149.75 15.4 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.316 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 169.261 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.531 HD21 ' CD1' ' A' ' 32' ' ' LEU . 37.2 mt -118.56 122.16 41.96 Favored 'General case' 0 N--CA 1.412 -2.34 0 O-C-N 124.453 1.096 . . . . 0.0 112.432 178.548 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.477 HD12 ' N ' ' A' ' 92' ' ' LEU . 1.7 mp -129.88 157.56 76.44 Favored Pre-proline 0 C--N 1.3 -1.546 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 -178.35 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -63.77 169.56 9.95 Favored 'Trans proline' 0 CA--C 1.5 -1.204 0 C-N-CA 122.442 2.095 . . . . 0.0 110.243 176.205 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 18.5 m -36.71 -56.4 0.84 Allowed 'General case' 0 C--N 1.322 -0.601 0 O-C-N 124.611 1.194 . . . . 0.0 110.738 170.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -59.2 -36.86 76.11 Favored 'General case' 0 C--O 1.199 -1.575 0 C-N-CA 124.812 1.245 . . . . 0.0 112.392 -174.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.596 ' O ' HD22 ' A' ' 100' ' ' LEU . . . -59.02 -62.74 5.88 Favored Glycine 0 N--CA 1.423 -2.23 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 179.363 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.453 ' HB2' ' HB2' ' A' ' 31' ' ' TYR . 68.8 t-105 -52.69 -49.79 64.6 Favored 'General case' 0 C--N 1.315 -0.893 0 C-N-CA 124.717 1.207 . . . . 0.0 110.488 177.686 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.481 ' O ' ' HB2' ' A' ' 102' ' ' SER . 34.4 t30 -53.49 -31.49 46.13 Favored 'General case' 0 N--CA 1.419 -2.014 0 C-N-CA 126.787 2.035 . . . . 0.0 111.962 178.339 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 52.7 mttm -78.22 -49.57 13.51 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-N 118.103 0.41 . . . . 0.0 110.402 174.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.596 HD22 ' O ' ' A' ' 96' ' ' GLY . 1.0 OUTLIER -57.4 -42.72 82.79 Favored 'General case' 0 C--O 1.24 0.567 0 CA-C-O 121.476 0.655 . . . . 0.0 111.362 -179.484 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 49.1 t -71.66 -27.99 29.79 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.809 0 C-N-CA 123.768 0.827 . . . . 0.0 111.091 177.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . 0.481 ' HB2' ' O ' ' A' ' 98' ' ' ASN . 22.7 t -71.23 -34.08 70.46 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 178.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' TRP . . . . . . . . . . . . . 41.1 m0 -83.96 -54.0 5.17 Favored 'General case' 0 N--CA 1.423 -1.811 0 CA-C-N 115.266 -0.879 . . . . 0.0 112.239 -175.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -127.51 10.72 6.73 Favored 'General case' 0 CA--C 1.502 -0.88 0 N-CA-C 114.359 1.244 . . . . 0.0 114.359 -173.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 24.8 p 56.64 172.0 0.04 OUTLIER 'General case' 0 N--CA 1.411 -2.385 0 N-CA-C 116.774 2.139 . . . . 0.0 116.774 178.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.07 153.37 17.68 Favored 'General case' 0 C--N 1.282 -2.337 0 N-CA-C 105.831 -1.914 . . . . 0.0 105.831 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . 0.582 ' HG3' ' HB2' ' A' ' 66' ' ' ASP . 65.3 mmm -64.62 156.17 30.94 Favored 'General case' 0 CA--C 1.493 -1.225 0 CA-C-O 121.299 0.571 . . . . 0.0 110.348 173.418 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -74.78 149.03 39.86 Favored 'General case' 0 N--CA 1.407 -2.609 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.043 -179.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 83.47 -34.55 2.89 Favored Glycine 0 N--CA 1.423 -2.183 0 CA-C-N 115.251 -0.886 . . . . 0.0 112.109 -178.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -79.0 150.67 31.89 Favored 'General case' 0 N--CA 1.411 -2.395 0 CA-C-O 121.302 0.573 . . . . 0.0 111.116 179.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -133.01 146.42 61.19 Favored Pre-proline 0 N--CA 1.406 -2.646 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -48.63 128.39 18.17 Favored 'Trans proline' 0 CA--C 1.467 -2.825 0 C-N-CA 124.097 3.198 . . . . 0.0 114.544 -174.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.618 HG22 HD13 ' A' ' 32' ' ' LEU . 45.9 mt -85.21 107.47 16.08 Favored 'Isoleucine or valine' 1 N--CA 1.371 -4.384 0 CA-C-N 113.28 -1.782 . . . . 0.0 106.879 175.809 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . 0.405 ' HB1' ' CG2' ' A' ' 29' ' ' THR . . . -103.86 135.64 45.03 Favored 'General case' 0 C--N 1.275 -2.656 0 CA-C-O 121.446 0.641 . . . . 0.0 110.823 -178.491 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.531 ' HB2' HD11 ' A' ' 32' ' ' LEU . 13.2 tpt180 -136.25 126.97 27.26 Favored 'General case' 0 CA--C 1.455 -2.697 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 179.151 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.84 -176.27 3.82 Favored 'General case' 0 C--N 1.253 -3.622 0 CA-C-O 123.358 1.552 . . . . 0.0 112.125 179.186 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.577 HG12 ' HB2' ' A' ' 24' ' ' LEU . 9.0 m . . . . . 1 N--CA 1.371 -4.394 0 CA-C-N 111.249 -2.705 . . . . 0.0 111.77 172.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.588 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . . . . . . 0 N--CA 1.422 -1.844 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.601 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 23.3 t70 -69.02 151.35 46.6 Favored 'General case' 0 C--O 1.194 -1.847 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 174.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -41.05 -52.49 3.18 Favored 'General case' 0 C--N 1.307 -1.258 0 C-N-CA 126.263 1.825 . . . . 0.0 112.447 177.373 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -68.91 -31.02 69.62 Favored 'General case' 0 C--N 1.271 -2.808 0 CA-C-N 113.593 -1.639 . . . . 0.0 110.221 -175.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.588 ' CG2' ' HB1' ' A' ' 7' ' ' ALA . 16.5 m -73.65 -44.3 57.18 Favored 'General case' 1 N--CA 1.377 -4.098 0 CA-C-N 114.57 -1.196 . . . . 0.0 110.786 177.847 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.601 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 45.9 mt-30 -56.78 -57.27 13.17 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 122.651 0.38 . . . . 0.0 111.589 -173.512 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.501 ' HB3' HG13 ' A' ' 45' ' ' VAL . 0.0 OUTLIER -52.95 -41.37 64.44 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-O 121.151 0.501 . . . . 0.0 112.165 177.029 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.5 m -69.72 -47.16 64.09 Favored 'General case' 0 C--N 1.291 -1.965 0 CA-C-N 115.668 -0.697 . . . . 0.0 111.572 -178.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.575 ' O ' ' HB ' ' A' ' 18' ' ' THR . 13.5 t70 -61.31 -43.75 98.36 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 124.487 1.115 . . . . 0.0 110.64 -178.079 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.61 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 32.0 mm -72.88 -37.26 54.0 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.998 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.055 -178.375 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.405 ' O ' ' HG3' ' A' ' 21' ' ' LYS . . . -61.6 -36.99 82.27 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.575 ' HB ' ' O ' ' A' ' 15' ' ' ASP . 6.3 m -62.15 -33.99 75.55 Favored 'General case' 0 N--CA 1.408 -2.549 0 C-N-CA 125.898 1.679 . . . . 0.0 111.741 178.314 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 73.5 mt -85.79 -13.95 46.64 Favored 'General case' 0 C--N 1.27 -2.875 0 O-C-N 121.258 -0.901 . . . . 0.0 111.886 -177.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.61 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 14.3 mt -86.33 -26.88 24.64 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.611 0.72 . . . . 0.0 109.485 177.376 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.405 ' HG3' ' O ' ' A' ' 17' ' ' ALA . 0.1 OUTLIER -89.36 -7.66 54.81 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-O 122.35 1.071 . . . . 0.0 111.659 -174.507 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 15.2 m -75.73 136.71 40.32 Favored 'General case' 0 N--CA 1.386 -3.625 0 CA-C-N 113.207 -1.815 . . . . 0.0 110.729 176.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.5 m -75.03 142.86 43.75 Favored 'General case' 0 N--CA 1.403 -2.809 0 CA-C-N 113.724 -1.58 . . . . 0.0 111.549 178.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.534 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP . 0.5 OUTLIER -98.52 179.56 4.66 Favored 'General case' 0 N--CA 1.423 -1.812 0 N-CA-C 114.228 1.196 . . . . 0.0 114.228 -178.312 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.584 ' O ' HG21 ' A' ' 117' ' ' VAL . 3.6 mmp_? -127.23 -145.52 0.32 Allowed 'General case' 0 C--O 1.203 -1.383 0 C-N-CA 123.466 0.706 . . . . 0.0 110.894 -172.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -119.24 122.46 41.99 Favored 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 171.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 68.23 36.53 85.17 Favored Glycine 0 C--O 1.224 -0.493 0 N-CA-C 110.857 -0.897 . . . . 0.0 110.857 -177.086 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.455 ' HB2' ' HB2' ' A' ' 25' ' ' ARG . 34.1 t70 -79.23 -8.68 59.22 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-O 121.786 0.803 . . . . 0.0 111.989 -174.509 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.471 ' HA ' ' HA ' ' A' ' 116' ' ' LYS . 25.9 m 49.55 110.2 0.0 OUTLIER 'General case' 0 C--N 1.282 -2.344 0 C-N-CA 127.159 2.184 . . . . 0.0 114.369 -176.147 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.534 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 13.1 m95 -114.25 134.62 54.81 Favored 'General case' 0 C--N 1.3 -1.564 0 CA-C-N 114.693 -1.14 . . . . 0.0 109.172 -178.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -104.44 147.96 26.97 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 111.367 0.136 . . . . 0.0 111.367 -174.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.667 ' HA ' ' O ' ' A' ' 90' ' ' ILE . 5.8 mp -93.24 144.85 24.9 Favored 'General case' 0 CA--C 1.491 -1.307 0 N-CA-C 114.328 1.232 . . . . 0.0 114.328 -175.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 75.4 t -131.11 140.94 47.34 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.715 0 N-CA-C 105.871 -1.9 . . . . 0.0 105.871 173.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.493 ' HA ' HD11 ' A' ' 70' ' ' LEU . 20.1 t0 -64.62 131.61 47.47 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 173.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.44 ' O ' ' HE3' ' A' ' 39' ' ' LYS . 47.6 t -59.79 -37.54 79.39 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.262 -176.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 88.5 mtm180 -68.48 -34.31 75.71 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.848 -174.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.485 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 65.3 t90 -66.11 -46.37 77.84 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 177.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.532 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 32.7 t80 -64.7 -41.63 95.88 Favored 'General case' 0 C--O 1.206 -1.187 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.135 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.494 ' HG3' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.27 -38.98 69.28 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 118.394 0.543 . . . . 0.0 111.868 173.394 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.485 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 22.9 tp60 -65.58 -41.85 92.43 Favored 'General case' 0 N--CA 1.421 -1.906 0 CA-C-O 121.279 0.562 . . . . 0.0 109.854 175.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.4 ' HZ2' ' HB3' ' A' ' 12' ' ' GLN . 77.1 t90 -63.09 -39.68 95.43 Favored 'General case' 0 N--CA 1.437 -1.097 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.001 178.198 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.532 ' HG3' ' O ' ' A' ' 38' ' ' PHE . 35.8 mtmt -57.65 -40.08 78.48 Favored 'General case' 0 CA--C 1.515 -0.396 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 178.518 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -61.24 -48.63 80.57 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.884 0.849 . . . . 0.0 109.862 176.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.631 ' HB2' HG23 ' A' ' 60' ' ' VAL . 2.1 t80 -66.48 -41.92 88.22 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 113.548 -1.66 . . . . 0.0 112.709 -175.458 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.501 HG13 ' HB3' ' A' ' 13' ' ' ARG . 1.6 p -90.54 -15.99 8.37 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.05 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.789 -173.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.583 ' HA2' ' HB2' ' A' ' 52' ' ' LYS . . . 75.83 33.18 51.79 Favored Glycine 0 N--CA 1.416 -2.639 0 C-N-CA 121.249 -0.5 . . . . 0.0 112.119 -176.468 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.458 ' HB2' ' CG1' ' A' ' 45' ' ' VAL . 54.4 t80 -68.36 -45.48 72.68 Favored 'General case' 0 N--CA 1.44 -0.973 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.45 ' O ' ' HB3' ' A' ' 52' ' ' LYS . 70.2 m-20 -78.81 116.29 19.05 Favored 'General case' 0 CA--C 1.491 -1.29 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 178.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 36.0 m -66.63 -27.84 68.0 Favored 'General case' 0 C--N 1.291 -1.963 0 N-CA-C 111.8 0.296 . . . . 0.0 111.8 -178.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 45.0 p90 -82.57 -14.39 54.94 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.59 -178.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -154.53 101.06 2.31 Favored 'General case' 0 CA--C 1.488 -1.413 0 CA-C-O 121.417 0.627 . . . . 0.0 110.21 -179.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.583 ' HB2' ' HA2' ' A' ' 46' ' ' GLY . 22.8 pttp -156.91 21.41 0.32 Allowed 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 114.66 -1.154 . . . . 0.0 111.748 -171.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -70.79 -4.09 22.19 Favored 'General case' 0 C--N 1.266 -3.046 0 CA-C-N 114.503 -1.226 . . . . 0.0 110.177 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.436 ' HB3' HG11 ' A' ' 60' ' ' VAL . 0.2 OUTLIER -106.87 11.71 29.71 Favored 'General case' 0 N--CA 1.403 -2.779 0 C-N-CA 124.467 1.107 . . . . 0.0 109.167 -177.3 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . 0.589 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 50.0 ttm -60.98 103.56 0.28 Allowed 'General case' 0 N--CA 1.428 -1.555 0 C-N-CA 123.837 0.855 . . . . 0.0 110.914 179.56 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 89.54 15.69 58.04 Favored Glycine 0 N--CA 1.439 -1.117 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.873 -178.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.579 ' HB3' HG22 ' A' ' 60' ' ' VAL . 29.3 t0 -89.89 142.89 27.27 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 179.7 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -82.82 -16.25 48.48 Favored 'General case' 0 C--N 1.296 -1.72 0 CA-C-O 122.358 1.075 . . . . 0.0 109.061 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 66.3 m-20 -62.51 -26.3 68.47 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 114.317 -1.311 . . . . 0.0 111.171 175.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.631 HG23 ' HB2' ' A' ' 44' ' ' TYR . 27.3 m -123.33 1.95 5.78 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.693 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.113 -172.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -66.37 119.56 63.35 Favored Pre-proline 0 C--N 1.299 -1.594 0 C-N-CA 119.426 -0.91 . . . . 0.0 110.495 -178.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -87.22 117.07 1.25 Allowed 'Trans proline' 0 N--CA 1.413 -3.257 0 C-N-CA 122.529 2.153 . . . . 0.0 110.22 177.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -71.47 -145.35 0.41 Allowed Glycine 0 C--N 1.267 -3.26 0 CA-C-N 113.875 -1.511 . . . . 0.0 112.779 177.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -54.62 135.71 67.86 Favored 'Trans proline' 0 C--O 1.253 1.27 0 C-N-CA 123.001 2.468 . . . . 0.0 112.822 -177.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.568 HD11 ' HB3' ' A' ' 100' ' ' LEU . 57.2 mt -70.04 107.18 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.927 0 CA-C-N 115.133 -0.94 . . . . 0.0 112.029 -176.402 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -95.97 128.4 42.83 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.115 175.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.512 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 35.1 m-80 -124.21 11.82 8.83 Favored 'General case' 0 C--N 1.315 -0.933 0 O-C-N 123.96 0.787 . . . . 0.0 110.412 -179.006 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 23.0 t -59.95 -30.16 68.89 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -173.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -76.09 -13.28 83.37 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 121.479 -0.391 . . . . 0.0 112.547 -178.271 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.493 HD11 ' HA ' ' A' ' 34' ' ' ASP . 37.4 mt -91.08 -20.48 22.01 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 67' ' ' ASN . 44.9 mt -83.96 159.11 21.32 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.237 -170.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.455 ' HG3' ' C ' ' A' ' 79' ' ' LEU . 58.1 mtpt . . . . . 0 C--N 1.311 -1.081 0 CA-C-O 121.804 0.811 . . . . 0.0 111.797 178.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.476 ' HA ' HD13 ' A' ' 71' ' ' LEU . . . . . . . . 0 N--CA 1.445 -0.721 0 CA-C-O 122.151 0.977 . . . . 0.0 109.509 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -112.68 2.85 16.29 Favored 'General case' 0 C--N 1.303 -1.44 0 CA-C-O 122.242 1.02 . . . . 0.0 108.506 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.2 t -113.56 140.68 47.96 Favored 'General case' 0 C--N 1.287 -2.12 0 N-CA-C 106.364 -1.717 . . . . 0.0 106.364 177.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.505 ' HA ' ' HA ' ' A' ' 71' ' ' LEU . 1.0 OUTLIER -126.41 153.84 44.44 Favored 'General case' 0 N--CA 1.409 -2.495 0 C-N-CA 120.719 -0.392 . . . . 0.0 110.391 -174.49 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.61 ' HB2' HD13 ' A' ' 83' ' ' LEU . 66.2 mttm -55.25 144.23 25.34 Favored 'General case' 0 C--N 1.31 -1.144 0 N-CA-C 116.055 1.872 . . . . 0.0 116.055 -171.683 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -48.02 -58.24 4.71 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 127.218 2.207 . . . . 0.0 115.847 -172.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 41.4 m80 -91.84 -1.76 57.19 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 113.882 1.067 . . . . 0.0 113.882 -169.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.61 HD13 ' HB2' ' A' ' 80' ' ' LYS . 10.7 mp -59.98 127.5 32.21 Favored 'General case' 0 C--O 1.254 1.303 0 N-CA-C 115.307 1.595 . . . . 0.0 115.307 -176.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.65 HG21 HD12 ' A' ' 87' ' ' LEU . 61.8 mt -97.74 174.01 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 CA-C-N 112.67 -2.059 . . . . 0.0 107.029 177.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.517 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 18.3 t70 -61.59 -139.98 0.0 OUTLIER 'General case' 0 CA--C 1.581 2.173 0 C-N-CA 126.071 1.749 . . . . 0.0 110.684 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.63 ' HA ' ' O ' ' A' ' 89' ' ' TYR 0.252 0.2 OUTLIER -40.33 -18.86 0.01 OUTLIER 'General case' 0 N--CA 1.517 2.875 0 C-N-CA 127.333 2.253 . . . . 0.0 116.65 -171.811 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.65 HD12 HG21 ' A' ' 84' ' ' ILE . 54.7 mt -65.18 -59.15 4.41 Favored 'General case' 0 C--N 1.274 -2.678 0 C-N-CA 124.638 1.175 . . . . 0.0 110.847 172.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.417 ' HB3' ' HG ' ' A' ' 83' ' ' LEU . 36.4 m-20 -97.12 -39.18 9.43 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.709 -175.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' TYR . . . . . 0.63 ' O ' ' HA ' ' A' ' 86' ' ' GLU . 2.6 p90 -145.05 -164.34 1.91 Allowed 'General case' 0 C--O 1.162 -3.511 0 N-CA-C 105.172 -2.158 . . . . 0.0 105.172 -177.344 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.667 ' O ' ' HA ' ' A' ' 32' ' ' LEU . 3.1 mt -144.85 150.94 15.72 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.313 0 CA-C-N 120.25 1.386 . . . . 0.0 108.767 171.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.545 HD21 ' CD1' ' A' ' 32' ' ' LEU . 26.4 mt -119.98 117.98 29.47 Favored 'General case' 0 N--CA 1.393 -3.286 0 O-C-N 124.444 1.09 . . . . 0.0 110.936 175.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.513 ' HB3' ' HA3' ' A' ' 96' ' ' GLY . 1.2 mm? -111.95 161.14 27.15 Favored Pre-proline 0 CA--C 1.487 -1.48 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 177.334 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -59.78 168.22 5.87 Favored 'Trans proline' 0 C--O 1.257 1.432 0 C-N-CA 121.886 1.724 . . . . 0.0 108.158 165.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 34.1 m -50.89 -40.48 56.79 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 177.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.463 ' O ' ' HG2' ' A' ' 99' ' ' LYS . 6.3 mm-40 -57.12 -52.71 64.19 Favored 'General case' 0 C--O 1.198 -1.635 0 C-N-CA 124.021 0.929 . . . . 0.0 111.522 177.048 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.544 ' O ' HD22 ' A' ' 100' ' ' LEU . . . -54.23 -57.61 16.2 Favored Glycine 0 CA--C 1.495 -1.211 0 O-C-N 124.049 0.843 . . . . 0.0 112.082 -175.033 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 47.8 t-105 -53.66 -51.02 64.49 Favored 'General case' 0 C--N 1.289 -2.027 0 C-N-CA 123.512 0.725 . . . . 0.0 111.287 174.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -55.03 -28.79 54.9 Favored 'General case' 0 C--O 1.195 -1.782 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 175.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.644 ' HB3' ' CH2' ' A' ' 103' ' ' TRP . 19.0 mmtp -69.76 -57.14 5.47 Favored 'General case' 0 N--CA 1.41 -2.465 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 177.257 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.568 ' HB3' HD11 ' A' ' 65' ' ' ILE . 0.5 OUTLIER -58.88 -39.22 80.74 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.918 -176.94 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.523 ' O ' ' HA ' ' A' ' 105' ' ' THR . 55.2 t -75.6 -26.71 18.36 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.377 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.817 177.268 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 25.9 t -73.73 -39.08 64.53 Favored 'General case' 0 C--N 1.296 -1.725 0 O-C-N 120.96 -1.087 . . . . 0.0 108.583 176.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' TRP . . . . . 0.644 ' CH2' ' HB3' ' A' ' 99' ' ' LYS . 26.1 m0 -79.35 -49.51 12.29 Favored 'General case' 0 N--CA 1.437 -1.097 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.954 -174.369 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 64.5 m-85 -126.84 8.62 6.85 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 114.108 1.151 . . . . 0.0 114.108 -176.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.523 ' HA ' ' O ' ' A' ' 101' ' ' VAL 0.268 6.0 t 49.63 -174.58 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 126.608 1.963 . . . . 0.0 115.584 179.538 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -98.34 157.43 16.19 Favored 'General case' 0 C--N 1.247 -3.862 0 CA-C-N 112.733 -2.031 . . . . 0.0 107.45 -174.421 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 23.2 tpp -74.57 137.96 42.73 Favored 'General case' 1 N--CA 1.369 -4.475 0 CA-C-O 121.749 0.785 . . . . 0.0 109.311 175.372 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -63.35 123.49 18.83 Favored 'General case' 1 N--CA 1.362 -4.844 0 C-N-CA 126.188 1.795 . . . . 0.0 110.583 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 107.97 -15.25 37.12 Favored Glycine 0 N--CA 1.421 -2.31 0 CA-C-N 113.809 -1.541 . . . . 0.0 111.039 -177.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -104.02 156.74 17.61 Favored 'General case' 0 N--CA 1.434 -1.23 0 CA-C-O 121.885 0.85 . . . . 0.0 112.426 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -134.72 141.31 38.18 Favored Pre-proline 0 C--N 1.292 -1.919 0 N-CA-C 106.119 -1.808 . . . . 0.0 106.119 -177.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -48.73 125.34 12.57 Favored 'Trans proline' 0 CA--C 1.47 -2.684 0 C-N-CA 123.962 3.108 . . . . 0.0 115.263 -172.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.49 HG12 HD21 ' A' ' 71' ' ' LEU . 3.7 mp -90.73 109.22 20.64 Favored 'Isoleucine or valine' 1 N--CA 1.377 -4.092 0 CA-C-N 112.411 -2.177 . . . . 0.0 106.011 177.43 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -108.69 138.74 44.53 Favored 'General case' 0 C--N 1.281 -2.387 0 CA-C-O 121.927 0.87 . . . . 0.0 112.397 -177.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.563 ' HG3' HD11 ' A' ' 32' ' ' LEU . 11.8 mmm180 -120.57 -172.12 2.31 Favored 'General case' 0 C--N 1.282 -2.346 0 N-CA-C 104.126 -2.546 . . . . 0.0 104.126 173.031 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . 0.471 ' HA ' ' HA ' ' A' ' 29' ' ' THR . 24.4 pttm -135.48 -167.31 1.99 Allowed 'General case' 0 C--N 1.247 -3.871 0 N-CA-C 107.353 -1.351 . . . . 0.0 107.353 176.167 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.584 HG21 ' O ' ' A' ' 25' ' ' ARG . 59.4 t . . . . . 0 C--N 1.283 -2.291 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 171.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.509 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . . . . . . 0 N--CA 1.436 -1.148 0 CA-C-O 121.24 0.543 . . . . 0.0 111.307 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.51 ' O ' ' HB ' ' A' ' 11' ' ' THR . 21.2 t70 -74.7 149.25 39.95 Favored 'General case' 0 C--O 1.199 -1.57 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.378 178.246 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.41 ' HA ' ' HG3' ' A' ' 12' ' ' GLN . 18.7 mt -51.43 -38.53 54.08 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.635 0.774 . . . . 0.0 111.2 -177.47 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -67.51 -38.65 84.59 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-N 113.684 -1.598 . . . . 0.0 109.227 -176.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.51 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 8.2 m -74.05 -48.3 30.83 Favored 'General case' 0 N--CA 1.38 -3.929 0 CA-C-N 113.604 -1.634 . . . . 0.0 110.597 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.457 ' HB3' ' HZ2' ' A' ' 41' ' ' TRP . 14.5 mt-30 -52.51 -54.29 34.52 Favored 'General case' 0 CA--C 1.48 -1.721 0 O-C-N 123.903 0.752 . . . . 0.0 110.561 -174.688 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.664 ' HD3' HG21 ' A' ' 45' ' ' VAL . 4.0 mmm180 -70.6 -32.32 69.62 Favored 'General case' 0 CA--C 1.452 -2.797 0 N-CA-C 115.627 1.714 . . . . 0.0 115.627 -176.081 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 33.8 t -72.02 -45.54 60.5 Favored 'General case' 0 C--N 1.273 -2.72 0 O-C-N 123.971 0.794 . . . . 0.0 110.063 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -70.45 -31.41 68.57 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.927 -175.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.543 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 3.7 mm -80.88 -42.97 20.71 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.714 0 CA-C-N 115.297 -0.865 . . . . 0.0 112.222 176.606 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.531 ' O ' ' HG2' ' A' ' 21' ' ' LYS . . . -55.47 -37.29 67.6 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.484 ' HA ' ' HD3' ' A' ' 21' ' ' LYS . 1.2 m -63.1 -34.55 77.83 Favored 'General case' 0 N--CA 1.405 -2.718 0 CA-C-N 113.75 -1.568 . . . . 0.0 112.276 -179.284 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.419 HD11 ' HE3' ' A' ' 99' ' ' LYS . 82.9 mt -86.09 -14.03 45.48 Favored 'General case' 0 C--N 1.275 -2.643 0 O-C-N 121.694 -0.629 . . . . 0.0 112.305 -176.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 20.4 mt -84.11 -28.24 27.63 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 178.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.531 ' HG2' ' O ' ' A' ' 17' ' ' ALA . 19.2 ptmt -88.47 -23.35 23.27 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 114.705 -1.134 . . . . 0.0 110.945 -175.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.2 m -57.4 141.55 46.89 Favored 'General case' 0 N--CA 1.404 -2.761 0 C-N-CA 125.24 1.416 . . . . 0.0 111.233 173.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.3 m -87.33 170.11 11.69 Favored 'General case' 0 N--CA 1.403 -2.777 0 CA-C-N 114.027 -1.442 . . . . 0.0 111.969 -176.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.639 ' HB2' HG12 ' A' ' 117' ' ' VAL . 0.7 OUTLIER -112.78 163.91 14.02 Favored 'General case' 0 N--CA 1.408 -2.569 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 178.003 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 28.3 mmt180 -104.59 -159.55 0.72 Allowed 'General case' 0 C--N 1.297 -1.675 0 CA-C-N 114.514 -1.221 . . . . 0.0 108.186 176.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -109.64 18.72 19.98 Favored 'General case' 0 N--CA 1.42 -1.963 0 N-CA-C 106.808 -1.552 . . . . 0.0 106.808 175.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.485 ' N ' HG21 ' A' ' 117' ' ' VAL . . . -155.85 29.65 0.6 Allowed Glycine 0 N--CA 1.427 -1.959 0 CA-C-N 114.284 -1.326 . . . . 0.0 112.915 179.182 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.46 ' HB2' ' CG1' ' A' ' 117' ' ' VAL . 57.2 m-20 -95.69 153.36 17.77 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 119.189 -1.004 . . . . 0.0 109.6 176.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 98.9 m -104.99 129.21 53.48 Favored 'General case' 0 C--N 1.287 -2.122 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 174.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.532 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 40.9 m95 -116.51 139.11 50.83 Favored 'General case' 0 C--N 1.297 -1.696 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -178.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.436 ' HB2' ' HB2' ' A' ' 97' ' ' TRP . 72.3 m-85 -104.92 141.78 35.94 Favored 'General case' 0 C--N 1.276 -2.63 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.305 -176.013 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.504 HD11 ' HB2' ' A' ' 115' ' ' ARG . 6.0 mp -89.65 136.87 32.78 Favored 'General case' 0 CA--C 1.49 -1.344 0 O-C-N 124.383 1.052 . . . . 0.0 111.513 179.67 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.449 HG12 ' O ' ' A' ' 34' ' ' ASP . 81.7 t -121.74 140.36 45.98 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.868 0 N-CA-C 104.41 -2.441 . . . . 0.0 104.41 172.339 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.481 ' OD2' ' HB2' ' A' ' 36' ' ' ARG . 5.5 p-10 -69.69 127.38 32.76 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 106.153 -1.795 . . . . 0.0 106.153 172.157 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 69.6 p -67.37 -19.19 65.39 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-O 121.565 0.698 . . . . 0.0 110.899 -172.407 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.481 ' HB2' ' OD2' ' A' ' 34' ' ' ASP . 44.5 mtt180 -63.9 -48.06 78.14 Favored 'General case' 0 C--N 1.285 -2.235 0 C-N-CA 125.51 1.524 . . . . 0.0 108.29 -177.023 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.464 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 73.6 t90 -63.84 -48.09 78.18 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 124.597 1.159 . . . . 0.0 108.803 177.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.423 ' CG ' HD12 ' A' ' 90' ' ' ILE . 23.3 t80 -61.86 -40.04 93.95 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 114.858 -1.064 . . . . 0.0 111.614 -177.631 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -67.02 -34.36 77.56 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 175.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.464 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 23.8 tp60 -65.55 -42.39 91.94 Favored 'General case' 0 N--CA 1.423 -1.796 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 175.068 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.647 ' O ' HG22 ' A' ' 45' ' ' VAL . 47.8 t90 -66.04 -37.81 86.79 Favored 'General case' 0 N--CA 1.436 -1.14 0 CA-C-N 114.256 -1.338 . . . . 0.0 110.036 179.805 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.0 mtpp -53.72 -45.52 70.5 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.746 0.818 . . . . 0.0 113.177 175.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.47 ' HG2' ' OD2' ' A' ' 51' ' ' ASP . 51.5 mttm -65.31 -46.25 81.07 Favored 'General case' 0 CA--C 1.507 -0.676 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 177.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.453 ' HB2' HG23 ' A' ' 60' ' ' VAL . 3.5 t80 -55.29 -33.09 62.93 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 114.306 -1.315 . . . . 0.0 113.539 -179.448 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.664 HG21 ' HD3' ' A' ' 13' ' ' ARG . 5.7 m -102.45 -11.75 8.92 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -179.392 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.456 ' HA2' ' HB2' ' A' ' 52' ' ' LYS . . . 71.71 43.41 51.56 Favored Glycine 0 N--CA 1.415 -2.707 0 C-N-CA 120.003 -1.094 . . . . 0.0 111.554 -175.445 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -66.77 -45.1 79.57 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 176.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -83.44 153.87 24.25 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 115.225 -0.898 . . . . 0.0 108.958 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 5.4 p -84.51 -48.8 9.22 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-O 121.227 0.536 . . . . 0.0 111.921 -179.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 46.6 p90 -73.67 -16.6 61.21 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.752 -177.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.47 ' OD2' ' HG2' ' A' ' 43' ' ' LYS . 30.7 t70 -135.37 87.34 2.32 Favored 'General case' 0 CA--C 1.474 -1.954 0 CA-C-O 121.956 0.884 . . . . 0.0 111.159 -174.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.456 ' HB2' ' HA2' ' A' ' 46' ' ' GLY . 64.7 pttt -157.5 15.47 0.25 Allowed 'General case' 0 N--CA 1.429 -1.483 0 CA-C-N 113.835 -1.53 . . . . 0.0 112.236 -176.305 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 87.5 m-85 -64.1 -10.0 19.82 Favored 'General case' 0 C--N 1.292 -1.927 0 CA-C-N 114.922 -1.036 . . . . 0.0 110.356 173.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.59 ' HB3' HG11 ' A' ' 60' ' ' VAL . 11.0 mm100 -100.72 3.23 42.12 Favored 'General case' 0 N--CA 1.405 -2.724 0 C-N-CA 125.396 1.478 . . . . 0.0 110.753 -176.647 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . 0.404 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 48.7 ttp -65.09 109.13 2.05 Favored 'General case' 0 N--CA 1.426 -1.631 0 CA-C-O 121.227 0.537 . . . . 0.0 111.818 -176.311 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 89.95 2.36 75.04 Favored Glycine 0 N--CA 1.429 -1.777 0 CA-C-N 114.357 -1.292 . . . . 0.0 111.756 -178.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.501 ' HB3' HG22 ' A' ' 60' ' ' VAL . 4.8 t70 -77.28 152.27 34.68 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 -177.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.45 ' O ' ' HD2' ' A' ' 61' ' ' TYR . 20.7 pt20 -84.15 -24.32 30.27 Favored 'General case' 0 C--N 1.292 -1.895 0 CA-C-O 121.609 0.719 . . . . 0.0 109.809 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -61.13 -21.1 63.42 Favored 'General case' 0 CA--C 1.498 -1.039 0 CA-C-N 115.351 -0.84 . . . . 0.0 112.015 -179.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.59 HG11 ' HB3' ' A' ' 54' ' ' GLN . 28.8 m -119.47 2.39 7.18 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.073 0 CA-C-N 115.19 -0.914 . . . . 0.0 112.359 -173.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.45 ' HD2' ' O ' ' A' ' 58' ' ' GLN . 0.9 OUTLIER -65.3 114.63 16.19 Favored Pre-proline 0 C--N 1.314 -0.978 0 O-C-N 124.121 0.888 . . . . 0.0 110.504 -177.552 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -89.86 113.33 0.53 Allowed 'Trans proline' 0 N--CA 1.419 -2.871 0 C-N-CA 122.491 2.128 . . . . 0.0 109.688 177.052 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -70.64 -140.05 0.18 Allowed Glycine 0 C--N 1.281 -2.514 0 CA-C-N 114.923 -1.035 . . . . 0.0 113.163 177.094 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.402 ' HA ' ' O ' ' A' ' 104' ' ' TYR . 11.8 Cg_endo -56.16 145.24 77.28 Favored 'Trans proline' 0 C--O 1.252 1.205 0 C-N-CA 122.67 2.247 . . . . 0.0 112.739 -178.2 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 60.9 mt -72.63 117.09 15.67 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.98 -178.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.597 ' HB2' ' HG3' ' A' ' 107' ' ' MET . 17.0 t0 -116.33 104.53 11.57 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-O 121.896 0.855 . . . . 0.0 111.384 178.389 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.664 ' O ' HD23 ' A' ' 71' ' ' LEU . 42.9 m-80 -92.91 5.86 49.86 Favored 'General case' 0 C--N 1.284 -2.245 0 CA-C-N 114.899 -1.046 . . . . 0.0 111.04 -178.621 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 19.2 t -72.74 83.89 1.18 Allowed 'General case' 0 N--CA 1.445 -0.676 0 CA-C-O 122.523 1.154 . . . . 0.0 107.899 177.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 169.25 -20.74 0.08 OUTLIER Glycine 0 N--CA 1.42 -2.414 0 N-CA-C 108.45 -1.86 . . . . 0.0 108.45 -175.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.427 HD22 ' HB3' ' A' ' 89' ' ' TYR . 79.2 mt -88.41 -29.53 20.16 Favored 'General case' 0 CA--C 1.484 -1.568 0 N-CA-C 104.667 -2.345 . . . . 0.0 104.667 171.532 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.664 HD23 ' O ' ' A' ' 67' ' ' ASN . 2.2 mm? -75.88 156.79 33.99 Favored 'General case' 0 N--CA 1.38 -3.959 0 CA-C-N 110.781 -2.918 . . . . 0.0 107.084 173.114 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.457 ' HG3' ' O ' ' A' ' 78' ' ' SER . 38.0 mtpt . . . . . 0 C--N 1.292 -1.892 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 -174.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.932 0 CA-C-O 121.147 0.499 . . . . 0.0 109.71 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . 0.605 ' HA ' HE21 ' A' ' 77' ' ' GLN . 0.0 OUTLIER -116.9 -14.17 10.67 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-O 121.732 0.777 . . . . 0.0 110.175 179.927 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.457 ' O ' ' HG3' ' A' ' 72' ' ' LYS . 20.2 m -108.15 119.71 40.27 Favored 'General case' 0 C--N 1.299 -1.629 0 CA-C-N 114.81 -1.086 . . . . 0.0 110.845 -175.276 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.575 HD11 HG21 ' A' ' 113' ' ' ILE . 3.0 mm? -81.58 148.8 28.93 Favored 'General case' 0 N--CA 1.437 -1.087 0 C-N-CA 123.914 0.886 . . . . 0.0 111.986 -179.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -63.68 151.9 40.59 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.557 176.452 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -75.1 -35.83 61.72 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-O 122.145 0.974 . . . . 0.0 108.653 -178.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 15.4 t-80 -88.07 12.8 12.58 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-N 114.486 -1.234 . . . . 0.0 112.795 -170.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.434 ' HB3' ' CE2' ' A' ' 89' ' ' TYR . 43.2 mt -57.23 141.63 45.88 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 114.263 1.208 . . . . 0.0 114.263 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.808 HG21 HD12 ' A' ' 87' ' ' LEU . 62.8 mt -137.14 166.49 25.37 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 N-CA-C 106.251 -1.759 . . . . 0.0 106.251 -178.519 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.579 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 17.7 t70 -62.55 -146.22 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.213 0 C-N-CA 125.582 1.553 . . . . 0.0 110.586 -178.097 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.712 ' HA ' ' O ' ' A' ' 89' ' ' TYR 0.271 0.0 OUTLIER -40.74 -18.19 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.662 0 N-CA-C 117.014 2.228 . . . . 0.0 117.014 -174.029 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.808 HD12 HG21 ' A' ' 84' ' ' ILE . 44.4 mt -61.02 -61.03 2.87 Favored 'General case' 0 C--N 1.281 -2.411 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.838 170.113 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -97.83 -41.19 8.16 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 -176.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' TYR . . . . . 0.712 ' O ' ' HA ' ' A' ' 86' ' ' GLU . 1.3 p90 -139.9 -169.15 2.66 Favored 'General case' 0 C--O 1.155 -3.892 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.571 -174.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.474 ' O ' ' HA ' ' A' ' 32' ' ' LEU . 10.3 mt -146.21 153.01 13.41 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.343 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 170.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.405 ' N ' HG22 ' A' ' 90' ' ' ILE . 81.7 mt -117.73 134.69 54.65 Favored 'General case' 0 N--CA 1.413 -2.302 0 O-C-N 124.2 0.938 . . . . 0.0 110.907 177.14 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.435 HD12 ' N ' ' A' ' 92' ' ' LEU . 1.8 mp -140.2 159.53 63.53 Favored Pre-proline 0 C--N 1.291 -1.971 0 N-CA-C 106.794 -1.558 . . . . 0.0 106.794 -177.516 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -63.46 168.75 10.8 Favored 'Trans proline' 0 C--O 1.256 1.389 0 C-N-CA 121.992 1.795 . . . . 0.0 110.251 175.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.435 ' HA ' ' CE1' ' A' ' 31' ' ' TYR . 33.0 m -42.8 -47.95 5.59 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 124.532 1.145 . . . . 0.0 110.799 172.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -66.21 -38.15 87.26 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-N 114.613 -1.176 . . . . 0.0 112.33 -175.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.471 ' O ' ' HG ' ' A' ' 100' ' ' LEU . . . -62.18 -51.3 57.64 Favored Glycine 0 N--CA 1.429 -1.815 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 -179.278 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.436 ' HB2' ' HB2' ' A' ' 31' ' ' TYR . 69.1 t-105 -57.54 -50.04 74.38 Favored 'General case' 0 N--CA 1.428 -1.566 0 CA-C-N 114.594 -0.803 . . . . 0.0 110.35 174.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -48.26 -45.22 34.28 Favored 'General case' 0 CA--C 1.489 -1.368 0 O-C-N 123.788 0.68 . . . . 0.0 111.621 176.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.419 ' HE3' HD11 ' A' ' 19' ' ' LEU . 60.5 mttm -66.4 -45.27 80.55 Favored 'General case' 0 N--CA 1.426 -1.639 0 CA-C-O 120.639 0.257 . . . . 0.0 110.625 -177.213 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 96' ' ' GLY . 64.9 mt -65.1 -34.23 77.92 Favored 'General case' 0 C--N 1.292 -1.934 0 CA-C-O 121.403 0.62 . . . . 0.0 111.289 -178.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.51 ' HA ' ' HA ' ' A' ' 105' ' ' THR . 8.8 t -78.84 -23.8 13.0 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.456 0 CA-C-O 121.771 0.796 . . . . 0.0 111.12 176.594 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 67.1 m -73.51 -37.98 65.5 Favored 'General case' 0 N--CA 1.418 -2.031 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 174.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' TRP . . . . . 0.45 ' CH2' ' HA ' ' A' ' 12' ' ' GLN . 44.8 m0 -84.34 -42.44 15.75 Favored 'General case' 0 N--CA 1.424 -1.758 0 CA-C-N 114.995 -1.002 . . . . 0.0 112.959 -174.28 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' TYR . . . . . 0.402 ' O ' ' HA ' ' A' ' 64' ' ' PRO . 73.1 m-85 -127.63 -5.28 5.84 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 111.817 0.303 . . . . 0.0 111.817 -174.418 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.51 ' HA ' ' HA ' ' A' ' 101' ' ' VAL 0.288 13.7 t 50.62 -174.11 0.02 OUTLIER 'General case' 0 C--O 1.247 0.927 0 C-N-CA 125.788 1.635 . . . . 0.0 113.979 -173.69 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.425 ' HG ' ' N ' ' A' ' 107' ' ' MET . 37.1 tp -107.13 149.85 27.21 Favored 'General case' 0 C--N 1.244 -3.996 0 CA-C-N 113.305 -1.77 . . . . 0.0 109.057 -177.419 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . 0.597 ' HG3' ' HB2' ' A' ' 66' ' ' ASP . 80.3 mmm -59.38 154.37 16.99 Favored 'General case' 0 CA--C 1.492 -1.267 0 CA-C-O 122.131 0.967 . . . . 0.0 111.039 173.236 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -76.57 140.31 41.02 Favored 'General case' 0 N--CA 1.396 -3.165 0 CA-C-N 114.468 -1.242 . . . . 0.0 111.322 -176.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 88.84 -25.9 9.15 Favored Glycine 0 N--CA 1.412 -2.904 0 CA-C-N 114.743 -1.117 . . . . 0.0 113.667 175.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -92.01 172.19 8.61 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 119.681 -0.808 . . . . 0.0 109.355 -177.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -121.67 158.33 54.46 Favored Pre-proline 0 N--CA 1.432 -1.352 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -177.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . 0.409 ' HB3' ' CE2' ' A' ' 97' ' ' TRP . 22.9 Cg_exo -67.79 122.39 9.54 Favored 'Trans proline' 0 CA--C 1.448 -3.792 0 C-N-CA 122.358 2.039 . . . . 0.0 109.174 169.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.575 HG21 HD11 ' A' ' 79' ' ' LEU . 3.3 mp -82.79 109.33 16.55 Favored 'Isoleucine or valine' 1 N--CA 1.375 -4.208 0 CA-C-N 114.322 -1.308 . . . . 0.0 108.057 -178.637 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -102.13 137.98 39.69 Favored 'General case' 0 C--N 1.277 -2.574 0 CA-C-N 115.472 -0.786 . . . . 0.0 109.975 179.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.504 ' HB2' HD11 ' A' ' 32' ' ' LEU . 5.7 tpt180 -135.34 -178.71 5.23 Favored 'General case' 0 N--CA 1.402 -2.857 0 N-CA-C 103.841 -2.651 . . . . 0.0 103.841 178.269 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -137.03 179.27 6.48 Favored 'General case' 0 N--CA 1.402 -2.87 0 C-N-CA 118.217 -1.393 . . . . 0.0 113.27 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.639 HG12 ' HB2' ' A' ' 24' ' ' LEU . 7.3 m . . . . . 0 N--CA 1.383 -3.793 0 CA-C-N 111.408 -2.633 . . . . 0.0 112.915 174.083 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.472 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . . . . . . 0 CA--C 1.502 -0.887 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.682 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 13.8 t70 -69.14 145.46 53.32 Favored 'General case' 0 CA--C 1.467 -2.213 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 177.611 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -40.75 -51.53 3.07 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 126.083 1.753 . . . . 0.0 112.579 178.043 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -76.07 -31.55 58.83 Favored 'General case' 0 C--N 1.276 -2.587 0 CA-C-N 113.638 -1.619 . . . . 0.0 110.771 -176.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.502 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 3.7 m -65.14 -46.29 81.54 Favored 'General case' 0 N--CA 1.4 -2.94 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 177.271 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.682 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 53.7 mt-30 -54.66 -44.14 73.0 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-N 114.848 -1.069 . . . . 0.0 109.413 -179.081 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.474 ' CG ' ' HB ' ' A' ' 45' ' ' VAL . 3.2 mmp_? -70.32 -41.4 73.32 Favored 'General case' 0 N--CA 1.411 -2.387 0 N-CA-C 113.412 0.894 . . . . 0.0 113.412 -178.472 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.2 m -64.36 -46.3 84.02 Favored 'General case' 0 C--N 1.251 -3.683 0 CA-C-O 121.414 0.626 . . . . 0.0 110.484 -178.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.477 ' O ' ' HB ' ' A' ' 18' ' ' THR . 51.3 t0 -67.72 -46.83 71.07 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 114.659 -1.155 . . . . 0.0 109.671 -177.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.662 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 21.6 mm -71.94 -39.39 66.82 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.58 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.993 -177.449 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.487 ' O ' ' HG2' ' A' ' 21' ' ' LYS . . . -58.61 -34.8 71.54 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 -179.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.522 ' HA ' ' HE2' ' A' ' 21' ' ' LYS . 2.9 m -66.94 -42.07 85.92 Favored 'General case' 0 N--CA 1.4 -2.943 0 CA-C-N 113.975 -1.466 . . . . 0.0 111.905 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.456 HD11 ' HE3' ' A' ' 99' ' ' LYS . 82.0 mt -78.77 -12.67 60.03 Favored 'General case' 0 C--N 1.268 -2.962 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -175.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.662 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 20.6 mt -82.17 -31.48 30.42 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.098 -0.705 . . . . 0.0 109.098 176.264 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.522 ' HE2' ' HA ' ' A' ' 18' ' ' THR . 48.2 pttt -92.69 -25.93 18.02 Favored 'General case' 0 N--CA 1.425 -1.723 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.439 -174.101 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 31.8 m -67.73 137.67 55.66 Favored 'General case' 0 N--CA 1.398 -3.045 0 CA-C-O 122.336 1.065 . . . . 0.0 112.089 177.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.456 ' HA ' HD13 ' A' ' 24' ' ' LEU . 36.8 t -94.77 167.68 11.29 Favored 'General case' 0 N--CA 1.391 -3.421 0 CA-C-N 112.928 -1.942 . . . . 0.0 109.306 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.514 ' N ' HD13 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -105.19 177.95 4.7 Favored 'General case' 1 N--CA 1.377 -4.101 0 CA-C-N 112.834 -1.985 . . . . 0.0 114.301 -167.267 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.64 ' O ' HG21 ' A' ' 117' ' ' VAL . 25.1 mmt180 -134.13 143.24 47.83 Favored 'General case' 0 C--N 1.285 -2.215 0 CA-C-N 112.643 -2.071 . . . . 0.0 106.834 175.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 44.0 mtpt -67.9 95.19 0.51 Allowed 'General case' 0 C--N 1.306 -1.319 0 CA-C-O 121.808 0.813 . . . . 0.0 109.596 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 143.37 19.52 0.22 Allowed Glycine 0 N--CA 1.426 -1.971 0 CA-C-N 114.17 -1.377 . . . . 0.0 110.554 -174.355 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.403 ' HB2' ' CG2' ' A' ' 117' ' ' VAL . 37.1 m-20 -103.58 -179.63 4.0 Favored 'General case' 0 CA--C 1.499 -1.008 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 176.402 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 86.1 m -140.97 127.3 19.79 Favored 'General case' 0 N--CA 1.42 -1.958 0 N-CA-C 106.576 -1.638 . . . . 0.0 106.576 176.015 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.465 ' CZ2' HD12 ' A' ' 24' ' ' LEU . 42.2 m95 -112.84 119.4 37.88 Favored 'General case' 0 C--N 1.301 -1.502 0 CA-C-O 121.021 0.439 . . . . 0.0 109.988 -177.172 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.456 ' HB2' ' HB2' ' A' ' 97' ' ' TRP . 86.5 m-85 -94.36 148.67 21.99 Favored 'General case' 0 C--N 1.277 -2.545 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.594 -176.154 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.561 ' HA ' ' O ' ' A' ' 90' ' ' ILE . 6.2 mp -98.1 139.72 33.49 Favored 'General case' 0 CA--C 1.475 -1.932 0 O-C-N 124.042 0.839 . . . . 0.0 111.008 178.567 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.401 ' HA ' ' OD1' ' A' ' 67' ' ' ASN . 59.4 t -118.44 138.68 48.37 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.878 0 N-CA-C 105.52 -2.03 . . . . 0.0 105.52 172.343 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.51 ' OD1' ' HG2' ' A' ' 36' ' ' ARG . 19.5 t0 -63.8 128.7 36.98 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 106.86 -1.533 . . . . 0.0 106.86 171.777 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 83.0 p -68.15 -27.12 66.15 Favored 'General case' 0 C--O 1.193 -1.91 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 -170.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.51 ' HG2' ' OD1' ' A' ' 34' ' ' ASP . 19.1 mmt180 -64.59 -39.34 93.55 Favored 'General case' 0 N--CA 1.433 -1.322 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.329 -175.774 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.481 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 66.8 t90 -68.41 -47.27 67.72 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 178.019 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.455 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 39.3 t80 -60.72 -39.71 89.63 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.422 -179.831 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.516 ' HA ' ' HE3' ' A' ' 42' ' ' LYS . 93.1 mttt -66.36 -32.29 73.59 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 122.819 0.448 . . . . 0.0 111.98 176.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.481 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 19.7 tp60 -68.94 -42.02 77.29 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 174.104 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.641 ' O ' HG22 ' A' ' 45' ' ' VAL . 52.9 t90 -64.45 -37.27 86.96 Favored 'General case' 0 N--CA 1.428 -1.574 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.685 177.165 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.516 ' HE3' ' HA ' ' A' ' 39' ' ' LYS . 7.2 mtmp? -51.37 -47.78 62.71 Favored 'General case' 0 C--N 1.369 1.424 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 175.222 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.47 ' HB3' ' HB2' ' A' ' 54' ' ' GLN . 63.3 mttm -55.03 -50.42 69.1 Favored 'General case' 0 CA--C 1.499 -1.009 0 O-C-N 124.178 0.924 . . . . 0.0 109.938 177.824 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.536 ' O ' ' HA ' ' A' ' 55' ' ' MET . 5.1 t80 -60.09 -38.99 84.55 Favored 'General case' 0 C--N 1.309 -1.152 0 CA-C-N 114.032 -1.44 . . . . 0.0 113.605 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.641 HG22 ' O ' ' A' ' 41' ' ' TRP . 0.2 OUTLIER -91.2 -30.04 4.8 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.519 0 N-CA-C 114.39 1.255 . . . . 0.0 114.39 -179.516 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.652 ' HA2' ' CB ' ' A' ' 52' ' ' LYS . . . 87.92 34.76 9.62 Favored Glycine 0 N--CA 1.4 -3.742 0 C-N-CA 120.229 -0.986 . . . . 0.0 112.69 -176.334 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.47 ' CD1' ' CZ ' ' A' ' 13' ' ' ARG . 89.9 t80 -60.7 -49.81 76.0 Favored 'General case' 0 CA--C 1.508 -0.672 0 CA-C-O 121.814 0.816 . . . . 0.0 110.257 177.502 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.525 ' HB3' ' HB3' ' A' ' 51' ' ' ASP . 1.5 t0 -81.94 -176.65 6.23 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 114.123 -1.399 . . . . 0.0 110.717 -168.257 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . 0.416 ' O ' ' HE2' ' A' ' 52' ' ' LYS . 16.9 m -91.68 -42.96 9.88 Favored 'General case' 0 C--N 1.292 -1.927 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.625 -177.333 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.483 ' CE2' ' HB2' ' A' ' 51' ' ' ASP . 64.8 p-90 -101.29 -20.17 15.34 Favored 'General case' 0 N--CA 1.395 -3.187 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 -176.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.525 ' HB3' ' HB3' ' A' ' 48' ' ' ASP . 31.0 t70 -103.37 78.62 1.63 Allowed 'General case' 0 CA--C 1.459 -2.548 0 CA-C-N 114.07 -1.423 . . . . 0.0 109.057 -169.343 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.652 ' CB ' ' HA2' ' A' ' 46' ' ' GLY . 65.5 pttt -169.92 3.55 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.429 0 CA-C-N 113.632 -1.622 . . . . 0.0 114.829 -174.322 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -64.6 -9.59 20.46 Favored 'General case' 0 C--N 1.299 -1.598 0 CA-C-O 121.561 0.696 . . . . 0.0 110.898 175.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.47 ' HB2' ' HB3' ' A' ' 43' ' ' LYS . 13.1 mm100 -106.62 19.32 20.66 Favored 'General case' 0 N--CA 1.416 -2.147 0 C-N-CA 124.344 1.058 . . . . 0.0 109.832 -176.319 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . 0.536 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 48.8 ttm -58.69 109.17 0.75 Allowed 'General case' 0 N--CA 1.424 -1.768 0 CA-C-O 121.444 0.64 . . . . 0.0 111.335 -178.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.91 23.9 75.31 Favored Glycine 0 N--CA 1.439 -1.131 0 CA-C-N 115.177 -0.92 . . . . 0.0 112.195 -178.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -95.04 151.88 18.8 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-O 121.115 0.483 . . . . 0.0 110.786 -175.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -83.69 -21.33 32.4 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.103 -178.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -63.51 -18.86 64.25 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.03 -0.986 . . . . 0.0 111.918 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 12.7 m -115.24 -9.12 12.3 Favored 'Isoleucine or valine' 0 CA--C 1.443 -3.172 0 CA-C-O 118.327 -0.844 . . . . 0.0 112.834 -178.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 1.6 p90 -34.34 100.47 0.19 Allowed Pre-proline 0 CA--C 1.557 1.219 0 O-C-N 126.3 2.25 . . . . 0.0 114.181 -163.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -78.29 102.46 1.57 Allowed 'Trans proline' 0 N--CA 1.425 -2.543 0 C-N-CA 122.797 2.331 . . . . 0.0 109.777 174.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -82.01 -146.87 5.91 Favored Glycine 0 C--N 1.295 -1.715 0 CA-C-N 114.29 -1.323 . . . . 0.0 111.629 177.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.454 ' HA ' ' O ' ' A' ' 104' ' ' TYR . 86.8 Cg_exo -50.23 133.92 36.68 Favored 'Trans proline' 0 C--O 1.238 0.492 0 C-N-CA 123.763 2.975 . . . . 0.0 113.82 178.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.603 HD11 ' HB3' ' A' ' 100' ' ' LEU . 45.2 mt -68.53 115.12 6.25 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 CA-C-N 114.764 -1.107 . . . . 0.0 111.437 -176.07 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -110.82 121.24 44.85 Favored 'General case' 0 C--N 1.289 -2.033 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 173.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.401 ' OD1' ' HA ' ' A' ' 33' ' ' VAL . 38.5 m-80 -109.03 18.47 20.6 Favored 'General case' 0 C--N 1.306 -1.3 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.725 -176.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 10.0 t -68.8 -2.7 10.08 Favored 'General case' 0 CA--C 1.552 1.039 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -176.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -83.74 -19.88 60.81 Favored Glycine 0 N--CA 1.441 -1.011 0 N-CA-C 111.607 -0.597 . . . . 0.0 111.607 176.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 64.7 mt -91.09 -25.89 19.4 Favored 'General case' 0 CA--C 1.499 -1.018 0 CA-C-O 121.79 0.805 . . . . 0.0 109.699 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 50.1 mt -71.36 129.48 38.93 Favored 'General case' 0 N--CA 1.421 -1.876 0 CA-C-N 114.087 -1.415 . . . . 0.0 110.892 -173.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 73.2 tttt . . . . . 0 N--CA 1.402 -2.867 0 CA-C-N 114.483 -1.235 . . . . 0.0 109.824 -178.766 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.463 0 CA-C-O 121.88 0.848 . . . . 0.0 110.567 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 20.8 mm-40 -112.41 -3.21 14.53 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-O 122.414 1.102 . . . . 0.0 108.221 178.162 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 68.0 m -100.74 137.45 39.12 Favored 'General case' 0 C--N 1.284 -2.252 0 CA-C-N 113.481 -1.69 . . . . 0.0 109.586 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.576 HD21 HG21 ' A' ' 113' ' ' ILE . 96.6 mt -106.94 153.02 23.16 Favored 'General case' 0 C--N 1.296 -1.718 0 CA-C-O 120.953 0.406 . . . . 0.0 111.402 -178.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.417 ' HB2' ' HG ' ' A' ' 83' ' ' LEU . 67.9 mttm -65.14 153.09 41.89 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.28 175.069 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -77.0 -33.84 57.55 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 114.581 1.326 . . . . 0.0 114.581 -169.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 19.5 t-80 -98.35 11.76 37.02 Favored 'General case' 0 C--N 1.298 -1.658 0 CA-C-O 120.696 0.284 . . . . 0.0 111.726 -172.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.417 ' HG ' ' HB2' ' A' ' 80' ' ' LYS . 83.2 mt -66.36 118.63 10.29 Favored 'General case' 0 C--N 1.307 -1.259 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -176.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.563 HG21 HD12 ' A' ' 87' ' ' LEU . 44.8 mm -92.56 170.43 1.23 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 N-CA-C 106.674 -1.602 . . . . 0.0 106.674 175.398 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.654 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 22.4 t70 -60.62 -130.53 0.0 OUTLIER 'General case' 0 CA--C 1.577 2.011 0 C-N-CA 125.472 1.509 . . . . 0.0 112.403 -177.589 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.703 ' HA ' ' O ' ' A' ' 89' ' ' TYR . 9.6 pt-20 -47.51 -17.39 0.09 Allowed 'General case' 0 N--CA 1.5 2.075 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 -176.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.563 HD12 HG21 ' A' ' 84' ' ' ILE . 11.8 mt -67.65 -54.22 21.43 Favored 'General case' 0 C--N 1.29 -2.005 0 CA-C-N 115.201 -0.909 . . . . 0.0 110.394 176.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -101.48 -33.8 9.81 Favored 'General case' 0 CA--C 1.499 -0.989 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.136 -178.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' TYR . . . . . 0.703 ' O ' ' HA ' ' A' ' 86' ' ' GLU . 4.8 p90 -141.11 -160.61 1.1 Allowed 'General case' 0 C--O 1.183 -2.398 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 -179.188 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.561 ' O ' ' HA ' ' A' ' 32' ' ' LEU . 1.2 mm -141.19 145.43 24.98 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.879 0 N-CA-C 106.908 -1.515 . . . . 0.0 106.908 172.24 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.49 HD23 ' HA ' ' A' ' 91' ' ' LEU . 58.2 mt -116.93 123.9 48.09 Favored 'General case' 0 N--CA 1.42 -1.967 0 CA-C-O 121.784 0.802 . . . . 0.0 111.122 171.035 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.55 HD11 ' HB ' ' A' ' 90' ' ' ILE . 1.0 OUTLIER -137.07 155.38 76.15 Favored Pre-proline 0 C--N 1.289 -2.049 0 CA-C-N 114.171 -1.377 . . . . 0.0 108.526 -175.493 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -61.56 169.24 7.06 Favored 'Trans proline' 0 C--O 1.255 1.338 0 C-N-CA 123.213 2.609 . . . . 0.0 110.786 176.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.468 HG22 ' ND2' ' A' ' 98' ' ' ASN . 32.3 m -47.17 -43.28 21.04 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 123.96 0.788 . . . . 0.0 109.406 173.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.536 ' HB3' ' HE2' ' A' ' 99' ' ' LYS . 9.2 mm-40 -56.28 -51.26 68.81 Favored 'General case' 0 C--O 1.196 -1.73 0 C-N-CA 124.422 1.089 . . . . 0.0 111.079 178.266 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.561 ' O ' HD22 ' A' ' 100' ' ' LEU . . . -50.87 -62.11 5.56 Favored Glycine 0 CA--C 1.497 -1.085 0 O-C-N 124.322 1.014 . . . . 0.0 111.567 -177.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.456 ' HB2' ' HB2' ' A' ' 31' ' ' TYR . 68.5 t-105 -53.5 -50.79 64.65 Favored 'General case' 0 C--N 1.309 -1.152 0 C-N-CA 123.696 0.799 . . . . 0.0 110.905 177.69 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.468 ' ND2' HG22 ' A' ' 94' ' ' THR . 91.3 m-20 -52.2 -34.57 46.08 Favored 'General case' 0 C--O 1.207 -1.148 0 O-C-N 123.562 0.539 . . . . 0.0 112.118 177.058 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.536 ' HE2' ' HB3' ' A' ' 95' ' ' GLU . 50.8 mttm -75.01 -51.67 13.01 Favored 'General case' 0 N--CA 1.412 -2.358 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.603 ' HB3' HD11 ' A' ' 65' ' ' ILE . 0.7 OUTLIER -58.95 -39.79 82.71 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.379 0.609 . . . . 0.0 111.534 -179.041 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.433 ' O ' ' HA ' ' A' ' 105' ' ' THR . 20.5 t -73.51 -31.08 31.63 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.172 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.851 177.559 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 37.5 t -73.91 -35.09 64.6 Favored 'General case' 0 C--N 1.314 -0.972 0 O-C-N 121.535 -0.728 . . . . 0.0 109.036 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' TRP . . . . . 0.442 ' CH2' ' HA ' ' A' ' 12' ' ' GLN . 49.4 m0 -78.24 -50.2 12.33 Favored 'General case' 0 N--CA 1.421 -1.924 0 CA-C-N 114.773 -1.103 . . . . 0.0 112.031 -176.731 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' TYR . . . . . 0.454 ' O ' ' HA ' ' A' ' 64' ' ' PRO . 55.2 m-85 -128.9 10.16 5.92 Favored 'General case' 0 CA--C 1.505 -0.764 0 N-CA-C 114.498 1.296 . . . . 0.0 114.498 -172.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.433 ' HA ' ' O ' ' A' ' 101' ' ' VAL 0.274 7.2 p 56.33 174.63 0.04 OUTLIER 'General case' 0 N--CA 1.418 -2.038 0 N-CA-C 117.025 2.231 . . . . 0.0 117.025 179.164 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.496 ' HG ' ' N ' ' A' ' 107' ' ' MET . 28.6 tp -104.93 161.59 14.07 Favored 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 114.57 -1.196 . . . . 0.0 108.487 -179.12 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . 0.496 ' N ' ' HG ' ' A' ' 106' ' ' LEU . 24.4 tpp -72.19 141.06 49.04 Favored 'General case' 0 N--CA 1.38 -3.967 0 CA-C-O 122.047 0.927 . . . . 0.0 109.241 173.26 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . 0.276 6.7 tp10 -74.99 125.87 29.81 Favored 'General case' 1 N--CA 1.346 -5.625 0 CA-C-N 113.504 -1.68 . . . . 0.0 110.181 -174.547 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 104.22 -6.25 46.31 Favored Glycine 0 N--CA 1.412 -2.959 0 CA-C-N 114.589 -1.187 . . . . 0.0 112.661 177.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.443 HE21 ' HB3' ' A' ' 110' ' ' GLN . 2.3 pt20 -109.34 158.08 18.25 Favored 'General case' 0 CA--C 1.494 -1.207 0 C-N-CA 117.936 -1.505 . . . . 0.0 109.805 177.252 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -122.39 133.47 24.4 Favored Pre-proline 0 C--N 1.286 -2.187 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -177.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -41.66 133.59 3.73 Favored 'Trans proline' 0 CA--C 1.477 -2.372 0 C-N-CA 124.687 3.591 . . . . 0.0 114.671 -177.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.576 HG21 HD21 ' A' ' 79' ' ' LEU . 3.6 mp -96.34 108.74 21.71 Favored 'Isoleucine or valine' 0 N--CA 1.385 -3.709 0 CA-C-N 113.053 -1.885 . . . . 0.0 107.007 179.437 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -113.72 147.89 37.4 Favored 'General case' 0 C--N 1.283 -2.283 0 CA-C-O 122.072 0.939 . . . . 0.0 113.024 -176.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.506 ' HG2' HD11 ' A' ' 32' ' ' LEU . 3.0 mmp_? -127.02 177.62 6.52 Favored 'General case' 0 CA--C 1.476 -1.867 0 N-CA-C 105.537 -2.023 . . . . 0.0 105.537 174.002 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -134.22 166.75 22.07 Favored 'General case' 0 C--N 1.258 -3.39 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.64 HG21 ' O ' ' A' ' 25' ' ' ARG . 59.8 t . . . . . 0 C--N 1.308 -1.222 0 CA-C-O 122.493 1.139 . . . . 0.0 111.386 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.454 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . . . . . . 0 CA--C 1.495 -1.162 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.611 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 12.5 t70 -68.24 144.3 54.95 Favored 'General case' 0 C--N 1.291 -1.961 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 173.373 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.479 ' O ' ' HG3' ' A' ' 13' ' ' ARG . 3.1 mm? -43.63 -53.12 5.94 Favored 'General case' 0 C--N 1.298 -1.662 0 C-N-CA 125.906 1.682 . . . . 0.0 112.67 177.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -67.9 -34.49 76.73 Favored 'General case' 0 C--N 1.276 -2.604 0 CA-C-N 114.61 -1.177 . . . . 0.0 110.293 -177.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.467 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 2.9 m -66.44 -46.66 75.73 Favored 'General case' 0 N--CA 1.384 -3.747 0 CA-C-N 114.99 -1.005 . . . . 0.0 110.522 178.042 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.611 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 71.0 mt-30 -56.1 -53.82 52.46 Favored 'General case' 0 N--CA 1.444 -0.758 0 O-C-N 123.548 0.53 . . . . 0.0 110.577 -177.581 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.524 ' HG2' HG13 ' A' ' 45' ' ' VAL . 59.2 mtt180 -46.64 -58.57 3.7 Favored 'General case' 0 N--CA 1.487 1.381 0 CA-C-O 122.432 1.11 . . . . 0.0 109.798 177.208 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 54.7 m -66.89 -45.49 77.86 Favored 'General case' 0 C--N 1.295 -1.787 0 CA-C-N 113.068 -1.878 . . . . 0.0 113.306 -170.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -67.82 -32.38 72.89 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.51 -175.188 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.536 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 27.7 mm -82.5 -38.29 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.142 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.274 177.106 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.07 -34.95 72.55 Favored 'General case' 0 CA--C 1.501 -0.941 0 CA-C-O 122.027 0.917 . . . . 0.0 108.73 179.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.452 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 2.6 m -64.81 -33.88 77.04 Favored 'General case' 0 N--CA 1.401 -2.912 0 CA-C-N 113.656 -1.611 . . . . 0.0 111.299 177.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.611 ' HB3' ' CG ' ' A' ' 93' ' ' PRO . 89.7 mt -85.94 -12.97 49.12 Favored 'General case' 0 C--N 1.267 -3.003 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -176.454 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.536 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 11.6 mt -86.43 -21.63 26.99 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 176.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.452 ' HE3' ' HA ' ' A' ' 18' ' ' THR . 0.0 OUTLIER -97.75 -4.44 37.06 Favored 'General case' 0 N--CA 1.426 -1.649 0 CA-C-N 114.537 -1.21 . . . . 0.0 111.333 -174.649 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.52 ' OG1' ' HA ' ' A' ' 19' ' ' LEU . 52.8 m -54.59 134.5 46.72 Favored 'General case' 0 N--CA 1.398 -3.075 0 C-N-CA 126.291 1.836 . . . . 0.0 111.351 173.323 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 68.3 m -70.48 132.64 45.87 Favored 'General case' 0 N--CA 1.387 -3.592 0 CA-C-N 113.405 -1.725 . . . . 0.0 111.338 179.121 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.49 HD22 HG13 ' A' ' 117' ' ' VAL . 1.7 pp -110.68 159.43 17.6 Favored 'General case' 0 N--CA 1.411 -2.408 0 CA-C-N 115.353 -0.84 . . . . 0.0 112.592 179.021 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.694 ' O ' HG11 ' A' ' 117' ' ' VAL . 19.9 mmt180 -105.51 -144.68 0.38 Allowed 'General case' 0 C--N 1.271 -2.821 0 N-CA-C 103.727 -2.694 . . . . 0.0 103.727 177.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.401 ' HA ' ' HB ' ' A' ' 117' ' ' VAL . 17.6 ptpt -128.91 14.93 6.36 Favored 'General case' 0 C--N 1.283 -2.323 0 CA-C-O 122.108 0.956 . . . . 0.0 109.868 166.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -130.89 20.53 4.8 Favored Glycine 0 N--CA 1.429 -1.803 0 CA-C-N 114.149 -1.387 . . . . 0.0 112.474 -179.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 45.0 m-20 -91.03 169.61 10.73 Favored 'General case' 0 CA--C 1.492 -1.258 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 177.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.512 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 85.1 m -118.67 130.68 55.98 Favored 'General case' 0 N--CA 1.409 -2.512 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 175.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.437 ' CZ2' HD23 ' A' ' 24' ' ' LEU . 33.4 m95 -114.7 155.98 25.63 Favored 'General case' 0 C--N 1.284 -2.277 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 177.008 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.546 ' HB2' ' HB2' ' A' ' 97' ' ' TRP . 84.9 m-85 -111.25 129.83 55.85 Favored 'General case' 0 C--N 1.264 -3.152 0 CA-C-O 121.04 0.448 . . . . 0.0 110.055 -178.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.8 HD11 ' CG ' ' A' ' 89' ' ' TYR . 26.3 tp -86.84 138.96 31.14 Favored 'General case' 1 N--CA 1.376 -4.17 0 N-CA-C 114.374 1.249 . . . . 0.0 114.374 -174.841 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.511 HG12 ' O ' ' A' ' 34' ' ' ASP . 46.3 t -132.85 154.04 39.02 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.465 0 C-N-CA 126.498 1.919 . . . . 0.0 107.821 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.522 ' CA ' HD21 ' A' ' 70' ' ' LEU . 23.0 t70 -71.09 144.11 50.42 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 173.299 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.456 ' HA ' HG13 ' A' ' 90' ' ' ILE . 50.2 p -71.98 -35.65 69.57 Favored 'General case' 0 C--N 1.277 -2.578 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.337 -171.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 17.0 mmm180 -80.75 -26.53 37.25 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 120.356 -0.538 . . . . 0.0 109.705 -174.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.489 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 67.1 t90 -65.99 -46.89 76.4 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 107.622 -1.251 . . . . 0.0 107.622 177.348 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.507 ' CG ' HD12 ' A' ' 90' ' ' ILE . 33.8 t80 -65.89 -37.65 86.67 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.329 179.488 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.477 ' HA ' ' HD3' ' A' ' 42' ' ' LYS . 94.6 mttt -67.03 -29.76 69.66 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 176.169 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.489 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 22.2 tp60 -66.78 -45.91 76.97 Favored 'General case' 0 N--CA 1.406 -2.67 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 173.007 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 67.4 t90 -59.83 -41.54 91.55 Favored 'General case' 0 C--O 1.213 -0.828 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.649 176.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.538 ' HG2' ' CD1' ' A' ' 47' ' ' PHE . 15.2 mtpp -56.73 -38.19 72.04 Favored 'General case' 0 N--CA 1.44 -0.947 0 C-N-CA 123.252 0.621 . . . . 0.0 112.298 -179.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.424 ' HD3' ' NE2' ' A' ' 54' ' ' GLN . 44.1 mttp -76.54 -37.95 55.84 Favored 'General case' 0 C--N 1.281 -2.391 0 CA-C-N 116.004 -0.543 . . . . 0.0 112.251 178.589 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.632 ' HB2' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -69.03 -35.57 76.76 Favored 'General case' 0 N--CA 1.412 -2.343 0 CA-C-N 114.857 -1.065 . . . . 0.0 109.59 -179.746 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.524 HG13 ' HG2' ' A' ' 13' ' ' ARG . 2.5 p -89.93 -22.28 6.46 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.654 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -177.223 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.481 ' HA2' ' CB ' ' A' ' 52' ' ' LYS . . . 87.67 28.84 23.01 Favored Glycine 0 N--CA 1.435 -1.41 0 C-N-CA 121.122 -0.561 . . . . 0.0 112.446 -174.269 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.538 ' CD1' ' HG2' ' A' ' 42' ' ' LYS . 32.7 t80 -77.44 -35.67 53.74 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 177.703 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.472 ' HB2' ' O ' ' A' ' 51' ' ' ASP . 26.6 m-20 -76.76 103.48 6.74 Favored 'General case' 0 CA--C 1.491 -1.315 0 N-CA-C 106.061 -1.829 . . . . 0.0 106.061 172.596 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 9.2 m -54.61 -32.18 58.36 Favored 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 -176.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 45.7 p90 -95.5 -9.32 32.82 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.26 -178.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.472 ' O ' ' HB2' ' A' ' 48' ' ' ASP . 17.5 t0 -139.94 83.85 1.94 Allowed 'General case' 0 CA--C 1.487 -1.447 0 CA-C-O 122.398 1.094 . . . . 0.0 109.27 -175.349 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.481 ' CB ' ' HA2' ' A' ' 46' ' ' GLY . 55.4 pttt -145.93 16.31 1.39 Allowed 'General case' 0 N--CA 1.409 -2.504 0 CA-C-N 113.819 -1.537 . . . . 0.0 111.226 -173.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 19.9 p90 -69.11 -7.53 36.96 Favored 'General case' 0 C--N 1.285 -2.212 0 CA-C-N 114.589 -1.187 . . . . 0.0 111.115 173.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.424 ' NE2' ' HD3' ' A' ' 43' ' ' LYS . 19.7 mt-30 -102.75 12.0 36.85 Favored 'General case' 0 N--CA 1.41 -2.454 0 CA-C-N 114.591 -1.186 . . . . 0.0 109.679 -178.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . 0.574 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 33.1 ttm -60.49 113.84 2.64 Favored 'General case' 0 N--CA 1.422 -1.835 0 CA-C-O 121.698 0.761 . . . . 0.0 111.898 -179.594 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 74.25 18.87 79.87 Favored Glycine 0 N--CA 1.431 -1.69 0 CA-C-N 114.736 -1.12 . . . . 0.0 111.558 -178.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.6 ' HB3' HG22 ' A' ' 60' ' ' VAL . 4.5 t0 -88.13 145.45 25.92 Favored 'General case' 0 CA--C 1.493 -1.215 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 -177.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.442 ' O ' ' HD1' ' A' ' 61' ' ' TYR . 11.5 pt20 -83.8 -8.66 59.18 Favored 'General case' 0 C--N 1.283 -2.313 0 CA-C-O 122.329 1.062 . . . . 0.0 110.535 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -72.99 -20.42 61.02 Favored 'General case' 0 C--N 1.288 -2.092 0 CA-C-N 114.419 -1.264 . . . . 0.0 111.003 173.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.632 HG23 ' HB2' ' A' ' 44' ' ' TYR . 35.4 m -128.1 7.9 3.07 Favored 'Isoleucine or valine' 0 CA--C 1.478 -1.805 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.375 -175.229 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.456 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 2.8 p90 -63.8 115.73 21.11 Favored Pre-proline 0 C--N 1.299 -1.593 0 O-C-N 124.098 0.874 . . . . 0.0 109.39 179.492 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' A' ' 61' ' ' TYR . 9.3 Cg_endo -87.19 111.86 0.87 Allowed 'Trans proline' 0 N--CA 1.417 -2.972 0 C-N-CA 122.37 2.046 . . . . 0.0 109.562 178.721 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -67.98 -147.19 0.14 Allowed Glycine 0 C--N 1.287 -2.162 0 CA-C-N 114.94 -1.027 . . . . 0.0 112.69 176.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -57.76 136.49 75.77 Favored 'Trans proline' 0 C--O 1.249 1.065 0 C-N-CA 122.101 1.868 . . . . 0.0 112.315 -177.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.482 HG12 ' CZ2' ' A' ' 37' ' ' TRP . 61.1 mt -62.79 110.17 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.074 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.912 -177.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -102.85 118.65 37.3 Favored 'General case' 0 C--N 1.299 -1.617 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.719 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -94.87 17.88 12.9 Favored 'General case' 0 C--N 1.296 -1.721 0 CA-C-N 115.71 -0.677 . . . . 0.0 112.615 179.544 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 19.4 m -79.67 24.57 0.37 Allowed 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 -176.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.445 ' H ' HD22 ' A' ' 70' ' ' LEU . . . -111.94 -21.7 6.24 Favored Glycine 0 CA--C 1.496 -1.104 0 N-CA-C 108.702 -1.759 . . . . 0.0 108.702 175.483 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.645 HD12 ' HB3' ' A' ' 89' ' ' TYR . 0.2 OUTLIER -102.72 -42.36 5.91 Favored 'General case' 0 N--CA 1.423 -1.791 0 CA-C-N 113.006 -1.597 . . . . 0.0 108.376 -173.45 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.55 HD13 ' HA ' ' A' ' 76' ' ' ALA . 91.2 mt -65.91 150.54 48.46 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-N 113.926 -1.488 . . . . 0.0 109.229 174.37 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt . . . . . 0 C--N 1.296 -1.758 0 CA-C-O 122.049 0.928 . . . . 0.0 111.471 -176.24 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.55 ' HA ' HD13 ' A' ' 71' ' ' LEU . . . . . . . . 0 CA--C 1.513 -0.449 0 CA-C-O 122.079 0.942 . . . . 0.0 110.301 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 20.1 mm-40 -120.45 5.91 10.64 Favored 'General case' 0 C--N 1.282 -2.339 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 53.9 m -119.39 124.29 46.22 Favored 'General case' 0 C--N 1.281 -2.408 0 CA-C-N 114.381 -1.282 . . . . 0.0 112.771 -173.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.411 HD21 HG21 ' A' ' 113' ' ' ILE . 82.6 mt -92.05 150.09 21.16 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.438 178.011 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.404 ' HB2' ' HG ' ' A' ' 83' ' ' LEU . 99.8 mttt -71.02 151.84 44.18 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.148 178.091 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -78.03 -23.54 48.16 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.798 -177.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 31.7 m170 -88.32 4.77 44.88 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -175.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.438 ' HB3' ' CE2' ' A' ' 89' ' ' TYR . 98.1 mt -65.71 133.38 50.94 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 114.497 1.295 . . . . 0.0 114.497 -173.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.736 HG21 HD12 ' A' ' 87' ' ' LEU . 43.0 mm -115.13 -178.91 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.086 0 N-CA-C 104.977 -2.231 . . . . 0.0 104.977 172.016 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.576 ' H ' HG22 ' A' ' 84' ' ' ILE . 21.7 t70 -71.54 -134.53 0.01 OUTLIER 'General case' 0 CA--C 1.57 1.724 0 CA-C-O 117.515 -1.231 . . . . 0.0 110.564 -178.074 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.674 ' HA ' ' O ' ' A' ' 89' ' ' TYR . 3.0 pp20? -45.53 -19.41 0.05 OUTLIER 'General case' 0 N--CA 1.51 2.543 0 N-CA-C 116.117 1.895 . . . . 0.0 116.117 -174.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.736 HD12 HG21 ' A' ' 84' ' ' ILE . 23.4 mt -59.76 -50.44 73.84 Favored 'General case' 0 C--N 1.287 -2.138 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.467 172.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -101.53 -50.01 3.86 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-N 114.753 -1.112 . . . . 0.0 111.342 -178.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' TYR . . . . . 0.8 ' CG ' HD11 ' A' ' 32' ' ' LEU . 0.5 OUTLIER -141.16 -175.7 4.42 Favored 'General case' 0 C--O 1.163 -3.472 0 C-N-CA 122.885 0.474 . . . . 0.0 110.968 -175.04 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.516 ' O ' HD12 ' A' ' 32' ' ' LEU . 7.1 mt -142.24 145.79 23.31 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.499 0 CA-C-N 118.943 0.792 . . . . 0.0 109.49 173.098 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.455 HD23 ' HA ' ' A' ' 91' ' ' LEU . 62.7 mt -109.72 133.58 52.96 Favored 'General case' 0 N--CA 1.405 -2.715 0 CA-C-N 114.662 -1.154 . . . . 0.0 111.841 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.402 HD22 ' N ' ' A' ' 92' ' ' LEU . 1.4 mm? -123.98 151.16 64.62 Favored Pre-proline 0 C--N 1.282 -2.332 0 CA-C-N 113.557 -1.656 . . . . 0.0 106.947 -177.57 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.611 ' CG ' ' HB3' ' A' ' 19' ' ' LEU . 11.1 Cg_endo -65.9 169.18 13.74 Favored 'Trans proline' 0 N--CA 1.443 -1.478 0 C-N-CA 121.937 1.758 . . . . 0.0 109.122 170.149 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 21.7 m -43.98 -48.35 8.66 Favored 'General case' 0 C--N 1.315 -0.917 0 O-C-N 123.518 0.512 . . . . 0.0 111.467 174.571 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -71.74 -34.69 69.73 Favored 'General case' 0 CA--C 1.491 -1.292 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.273 -176.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.547 ' O ' HD22 ' A' ' 100' ' ' LEU . . . -56.87 -62.26 6.56 Favored Glycine 0 N--CA 1.42 -2.389 0 N-CA-C 109.979 -1.248 . . . . 0.0 109.979 178.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.546 ' HB2' ' HB2' ' A' ' 31' ' ' TYR . 59.0 t-105 -50.75 -51.52 49.38 Favored 'General case' 0 N--CA 1.434 -1.227 0 C-N-CA 124.869 1.268 . . . . 0.0 110.215 176.184 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -49.15 -37.49 22.32 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 177.121 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 60.0 mttm -72.38 -51.67 19.43 Favored 'General case' 0 N--CA 1.416 -2.158 0 CA-C-O 119.434 -0.317 . . . . 0.0 110.386 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.547 HD22 ' O ' ' A' ' 96' ' ' GLY . 0.8 OUTLIER -56.94 -39.41 74.47 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.36 0.6 . . . . 0.0 111.504 179.09 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.484 ' O ' ' HA ' ' A' ' 105' ' ' THR . 53.7 t -72.26 -30.78 36.69 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.838 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.78 177.708 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 6.5 t -82.27 -24.96 34.47 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 121.07 -1.019 . . . . 0.0 108.889 -177.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' TRP . . . . . . . . . . . . . 47.2 m0 -83.64 -45.86 12.98 Favored 'General case' 0 N--CA 1.425 -1.683 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.598 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -131.42 7.64 4.56 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -175.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.484 ' HA ' ' O ' ' A' ' 101' ' ' VAL 0.304 35.2 p 57.77 168.37 0.04 OUTLIER 'General case' 0 N--CA 1.416 -2.139 0 N-CA-C 117.666 2.469 . . . . 0.0 117.666 -179.849 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -91.87 153.8 19.29 Favored 'General case' 0 C--N 1.291 -1.955 0 N-CA-C 105.781 -1.933 . . . . 0.0 105.781 -179.624 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 32.2 tpp -73.69 152.21 40.51 Favored 'General case' 0 N--CA 1.381 -3.913 0 CA-C-O 122.357 1.075 . . . . 0.0 110.887 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -63.6 135.31 56.7 Favored 'General case' 0 N--CA 1.395 -3.219 0 CA-C-N 112.979 -1.919 . . . . 0.0 110.006 179.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 80.25 5.77 89.55 Favored Glycine 0 N--CA 1.408 -3.203 0 CA-C-N 114.406 -1.27 . . . . 0.0 113.011 178.339 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -111.45 168.49 9.49 Favored 'General case' 0 CA--C 1.482 -1.64 0 CA-C-N 117.799 0.8 . . . . 0.0 110.975 177.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . 0.454 ' O ' HD12 ' A' ' 113' ' ' ILE . 7.5 mt-10 -142.87 144.4 29.31 Favored Pre-proline 0 C--N 1.276 -2.624 0 N-CA-C 106.511 -1.663 . . . . 0.0 106.511 -177.077 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_exo -58.58 122.76 12.19 Favored 'Trans proline' 0 CA--C 1.462 -3.101 0 C-N-CA 122.788 2.325 . . . . 0.0 112.773 -177.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.454 HD12 ' O ' ' A' ' 111' ' ' GLU . 3.2 mp -82.77 107.31 14.45 Favored 'Isoleucine or valine' 0 N--CA 1.383 -3.823 0 CA-C-N 113.248 -1.797 . . . . 0.0 107.052 175.586 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . 0.512 ' HB1' ' CG2' ' A' ' 29' ' ' THR . . . -92.46 124.95 36.87 Favored 'General case' 0 C--N 1.274 -2.7 0 CA-C-O 121.599 0.714 . . . . 0.0 109.44 177.454 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -127.78 124.06 36.75 Favored 'General case' 0 N--CA 1.401 -2.885 0 N-CA-C 105.403 -2.073 . . . . 0.0 105.403 -176.071 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -68.52 174.14 4.41 Favored 'General case' 0 C--N 1.29 -2.008 0 CA-C-O 121.651 0.738 . . . . 0.0 112.097 -177.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.694 HG11 ' O ' ' A' ' 25' ' ' ARG . 35.1 t . . . . . 0 C--N 1.306 -1.314 0 N-CA-C 105.633 -1.988 . . . . 0.0 105.633 169.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.473 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . . . . . . 0 CA--C 1.504 -0.8 0 CA-C-O 120.771 0.319 . . . . 0.0 111.031 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.609 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 16.5 t70 -72.84 146.67 46.08 Favored 'General case' 0 CA--C 1.481 -1.695 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 176.609 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -47.88 -48.74 31.23 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 124.65 1.18 . . . . 0.0 112.095 176.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -66.65 -37.58 85.11 Favored 'General case' 0 C--N 1.282 -2.341 0 CA-C-N 113.126 -1.852 . . . . 0.0 109.924 -178.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.473 ' CG2' ' HB1' ' A' ' 7' ' ' ALA . 3.4 m -65.37 -56.73 10.97 Favored 'General case' 0 N--CA 1.387 -3.576 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.548 177.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.609 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 76.5 mt-30 -44.55 -61.34 1.58 Allowed 'General case' 0 CA--C 1.508 -0.671 0 C-N-CA 125.035 1.334 . . . . 0.0 113.193 -173.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.488 ' HB3' HG21 ' A' ' 45' ' ' VAL . 0.0 OUTLIER -66.4 -35.34 80.07 Favored 'General case' 0 N--CA 1.432 -1.352 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 -174.6 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 33.1 t -77.75 -38.98 45.72 Favored 'General case' 0 C--N 1.28 -2.45 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.776 -178.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -65.62 -39.36 91.4 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 -177.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.604 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 34.8 mm -75.27 -39.64 42.54 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.383 0 CA-C-N 114.955 -1.02 . . . . 0.0 110.475 177.218 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.18 -33.66 72.52 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-O 121.531 0.681 . . . . 0.0 109.568 -178.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.57 ' HA ' ' HE2' ' A' ' 21' ' ' LYS . 1.0 OUTLIER -67.15 -31.33 71.68 Favored 'General case' 0 N--CA 1.407 -2.605 0 CA-C-N 114.25 -1.341 . . . . 0.0 112.153 178.791 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.486 ' HB3' ' HG2' ' A' ' 93' ' ' PRO . 71.3 mt -85.94 -16.97 36.7 Favored 'General case' 0 C--N 1.276 -2.59 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -177.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 11.0 mt -86.24 -24.42 26.03 Favored 'General case' 0 CA--C 1.502 -0.888 0 CA-C-O 121.231 0.539 . . . . 0.0 110.42 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.57 ' HE2' ' HA ' ' A' ' 18' ' ' THR . 39.6 pttt -86.74 -16.67 35.67 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.907 -171.57 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.4 m -55.33 137.56 47.45 Favored 'General case' 0 N--CA 1.402 -2.871 0 C-N-CA 125.662 1.585 . . . . 0.0 111.67 173.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.4 m -78.43 168.13 20.26 Favored 'General case' 0 N--CA 1.399 -2.994 0 CA-C-N 114.033 -1.44 . . . . 0.0 108.69 174.197 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.494 HD23 ' CZ2' ' A' ' 30' ' ' TRP 0.303 72.6 mt -74.69 138.47 42.84 Favored 'General case' 0 N--CA 1.397 -3.1 0 N-CA-C 116.321 1.971 . . . . 0.0 116.321 -173.812 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.497 ' HB2' ' HB2' ' A' ' 28' ' ' ASP . 7.4 mmm180 -81.54 -178.37 6.92 Favored 'General case' 0 C--N 1.29 -1.982 0 CA-C-N 111.288 -2.687 . . . . 0.0 107.746 -177.321 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 21.6 pttp -117.3 118.88 33.47 Favored 'General case' 0 C--N 1.292 -1.894 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 176.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 58.98 45.12 95.65 Favored Glycine 0 C--O 1.238 0.381 0 CA-C-O 121.479 0.488 . . . . 0.0 111.906 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.497 ' HB2' ' HB2' ' A' ' 25' ' ' ARG . 2.0 t0 -107.32 175.33 5.53 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 -177.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 31.2 m -119.19 123.41 44.29 Favored 'General case' 0 C--N 1.277 -2.581 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 179.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.494 ' CZ2' HD23 ' A' ' 24' ' ' LEU . 60.0 m95 -107.06 145.23 32.63 Favored 'General case' 0 C--N 1.279 -2.457 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 177.348 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.545 ' HB2' ' HB2' ' A' ' 97' ' ' TRP . 76.0 m-85 -109.01 127.58 54.21 Favored 'General case' 0 C--N 1.267 -3.01 0 CA-C-O 121.17 0.51 . . . . 0.0 110.933 -177.424 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.661 HD11 ' CD1' ' A' ' 89' ' ' TYR . 23.7 tp -88.33 134.06 33.91 Favored 'General case' 0 N--CA 1.379 -3.993 0 CA-C-N 114.095 -1.411 . . . . 0.0 114.514 -174.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 41.5 t -126.88 143.55 39.96 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.728 0 C-N-CA 126.64 1.976 . . . . 0.0 108.753 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.512 ' OD1' ' HB2' ' A' ' 36' ' ' ARG . 11.0 t70 -67.82 123.37 20.38 Favored 'General case' 0 C--N 1.307 -1.257 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 172.825 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 10.7 t -66.99 -24.26 66.02 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 120.664 0.269 . . . . 0.0 110.955 -172.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.512 ' HB2' ' OD1' ' A' ' 34' ' ' ASP . 13.9 mtm-85 -74.31 -25.23 59.45 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.241 0.544 . . . . 0.0 110.633 -177.159 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 69.5 t90 -72.74 -44.82 61.17 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 107.253 -1.388 . . . . 0.0 107.253 172.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.499 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 34.9 t80 -60.84 -37.84 83.42 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 114.773 -1.103 . . . . 0.0 110.798 178.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.441 ' HA ' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -52.65 -44.14 65.95 Favored 'General case' 0 C--N 1.352 0.714 0 N-CA-C 112.141 0.423 . . . . 0.0 112.141 174.026 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 22.0 tp60 -64.54 -43.39 94.13 Favored 'General case' 0 N--CA 1.423 -1.782 0 C-N-CA 123.127 0.571 . . . . 0.0 109.756 179.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.629 ' O ' HG22 ' A' ' 45' ' ' VAL . 74.0 t90 -60.3 -40.29 90.0 Favored 'General case' 0 N--CA 1.429 -1.513 0 CA-C-N 114.642 -1.163 . . . . 0.0 111.009 179.229 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.499 ' HG3' ' O ' ' A' ' 38' ' ' PHE . 34.0 mtmt -52.08 -46.28 65.14 Favored 'General case' 0 CA--C 1.494 -1.193 0 O-C-N 123.357 0.411 . . . . 0.0 111.955 -179.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 61.6 mttm -69.33 -45.22 69.98 Favored 'General case' 0 CA--C 1.479 -1.75 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.572 -176.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.567 ' HB2' HG23 ' A' ' 60' ' ' VAL . 0.2 OUTLIER -57.96 -33.01 68.4 Favored 'General case' 0 N--CA 1.424 -1.748 0 CA-C-N 115.287 -0.869 . . . . 0.0 112.782 179.487 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.629 HG22 ' O ' ' A' ' 41' ' ' TRP . 3.7 m -95.16 -17.21 7.12 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.194 0 N-CA-C 113.692 0.997 . . . . 0.0 113.692 178.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 78.32 39.47 22.55 Favored Glycine 0 C--N 1.302 -1.325 0 N-CA-C 109.139 -1.584 . . . . 0.0 109.139 -172.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.459 ' HB2' HG23 ' A' ' 45' ' ' VAL . 46.6 t80 -74.25 -37.6 63.73 Favored 'General case' 0 N--CA 1.439 -1.012 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 178.27 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -74.23 120.92 20.46 Favored 'General case' 0 CA--C 1.49 -1.343 0 N-CA-C 106.677 -1.601 . . . . 0.0 106.677 174.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . 0.534 ' HA ' ' HE3' ' A' ' 52' ' ' LYS . 30.5 m -58.65 -31.47 68.18 Favored 'General case' 0 C--N 1.298 -1.66 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -177.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 46.2 p90 -86.21 -15.0 42.26 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.354 -178.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 45.6 t0 -122.8 95.27 4.56 Favored 'General case' 0 CA--C 1.487 -1.476 0 CA-C-O 122.489 1.138 . . . . 0.0 110.871 -174.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.534 ' HE3' ' HA ' ' A' ' 49' ' ' SER . 34.3 mmtp -119.51 5.35 11.1 Favored 'General case' 0 C--N 1.284 -2.244 0 CA-C-N 113.624 -1.625 . . . . 0.0 108.621 -178.119 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 84.1 m-85 -78.54 -27.04 45.85 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.787 -174.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.566 ' HB3' HG11 ' A' ' 60' ' ' VAL . 9.5 mm100 -92.81 -3.11 55.27 Favored 'General case' 0 N--CA 1.404 -2.726 0 CA-C-N 114.746 -1.116 . . . . 0.0 110.683 -176.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . 0.461 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 45.4 ttm -60.73 115.46 3.67 Favored 'General case' 0 N--CA 1.423 -1.808 0 C-N-CA 122.535 0.334 . . . . 0.0 110.535 -178.315 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.86 16.99 80.29 Favored Glycine 0 N--CA 1.439 -1.143 0 CA-C-N 115.437 -0.802 . . . . 0.0 112.251 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.584 ' HB3' HG22 ' A' ' 60' ' ' VAL . 5.9 t0 -91.74 147.5 22.94 Favored 'General case' 0 CA--C 1.502 -0.876 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 -178.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -83.5 -18.69 37.6 Favored 'General case' 0 C--N 1.295 -1.804 0 CA-C-O 121.909 0.861 . . . . 0.0 108.893 178.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 76.9 m-20 -62.34 -21.32 65.21 Favored 'General case' 0 CA--C 1.504 -0.815 0 CA-C-N 114.654 -1.157 . . . . 0.0 111.705 178.011 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.584 HG22 ' HB3' ' A' ' 57' ' ' ASP . 27.3 m -122.98 15.0 5.41 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.629 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.944 -176.631 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.443 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 1.1 p90 -55.89 120.14 31.14 Favored Pre-proline 0 C--N 1.292 -1.905 0 O-C-N 124.477 1.11 . . . . 0.0 111.439 -178.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.482 ' HG3' ' HA ' ' A' ' 41' ' ' TRP . 6.9 Cg_endo -91.4 115.03 0.41 Allowed 'Trans proline' 0 N--CA 1.421 -2.759 0 C-N-CA 122.909 2.406 . . . . 0.0 110.377 172.46 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -75.82 -153.85 4.58 Favored Glycine 0 C--N 1.282 -2.447 0 CA-C-N 114.256 -1.338 . . . . 0.0 111.964 175.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.412 ' HA ' ' O ' ' A' ' 104' ' ' TYR . 31.9 Cg_exo -57.35 144.08 92.23 Favored 'Trans proline' 0 C--O 1.244 0.786 0 C-N-CA 122.883 2.389 . . . . 0.0 111.88 -179.121 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 68.4 mt -64.69 118.55 7.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.22 -176.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.428 ' HB2' ' HG3' ' A' ' 107' ' ' MET . 12.6 t70 -106.85 109.46 21.37 Favored 'General case' 0 N--CA 1.436 -1.157 0 O-C-N 123.461 0.475 . . . . 0.0 110.086 179.226 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.44 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 94.9 m-20 -100.9 11.65 39.17 Favored 'General case' 0 C--N 1.297 -1.686 0 CA-C-N 115.384 -0.825 . . . . 0.0 111.644 179.403 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 75.7 m -69.9 -16.86 63.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.019 0.438 . . . . 0.0 111.089 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -72.75 -19.0 79.1 Favored Glycine 0 N--CA 1.44 -1.074 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 175.022 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.467 ' CD2' ' HB3' ' A' ' 89' ' ' TYR . 74.6 mt -96.06 -35.07 11.5 Favored 'General case' 0 CA--C 1.496 -1.134 0 CA-C-O 121.262 0.553 . . . . 0.0 109.623 177.483 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.604 HD13 ' HA ' ' A' ' 76' ' ' ALA . 87.8 mt -69.81 150.02 47.3 Favored 'General case' 0 N--CA 1.425 -1.691 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.198 -178.821 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 47.1 mtpt . . . . . 0 C--N 1.305 -1.344 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 -173.404 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.604 ' HA ' HD13 ' A' ' 71' ' ' LEU . . . . . . . . 0 N--CA 1.444 -0.736 0 CA-C-O 121.957 0.884 . . . . 0.0 110.207 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 16.9 mm-40 -123.42 4.07 9.07 Favored 'General case' 0 C--N 1.281 -2.38 0 N-CA-C 107.598 -1.26 . . . . 0.0 107.598 -178.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.485 ' O ' ' HA ' ' A' ' 71' ' ' LEU . 70.7 m -132.6 131.93 41.97 Favored 'General case' 0 C--N 1.286 -2.153 0 CA-C-N 114.296 -1.32 . . . . 0.0 112.368 -173.166 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 36.7 tp -94.97 143.92 26.09 Favored 'General case' 0 N--CA 1.389 -3.524 0 C-N-CA 125.438 1.495 . . . . 0.0 108.706 -178.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 56.1 mtmt -66.94 158.15 31.52 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 -178.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -69.81 -49.91 48.09 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 114.336 1.236 . . . . 0.0 114.336 -167.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 29.9 m170 -93.48 12.01 26.57 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.439 0.903 . . . . 0.0 113.439 -170.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 16.3 mt -72.69 130.38 40.39 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-O 121.701 0.762 . . . . 0.0 112.555 -174.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.658 HG21 HD12 ' A' ' 87' ' ' LEU . 50.7 mm -101.19 175.13 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.935 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 -179.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.566 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 6.3 p-10 -64.59 -141.15 0.0 OUTLIER 'General case' 0 C--O 1.2 -1.538 0 C-N-CA 124.915 1.286 . . . . 0.0 112.158 -177.601 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.547 ' HA ' ' O ' ' A' ' 89' ' ' TYR . 0.0 OUTLIER -40.88 -19.9 0.01 OUTLIER 'General case' 0 N--CA 1.516 2.868 0 N-CA-C 115.804 1.779 . . . . 0.0 115.804 -173.865 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.658 HD12 HG21 ' A' ' 84' ' ' ILE . 15.2 mt -58.4 -53.52 57.41 Favored 'General case' 0 C--N 1.29 -2.017 0 C-N-CA 124.056 0.943 . . . . 0.0 109.88 171.618 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -107.11 -40.57 5.39 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.266 0.555 . . . . 0.0 111.138 -178.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' TYR . . . . . 0.661 ' CD1' HD11 ' A' ' 32' ' ' LEU . 1.8 p90 -140.31 174.13 10.82 Favored 'General case' 0 C--O 1.159 -3.671 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.832 -175.091 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.506 ' O ' HD12 ' A' ' 32' ' ' LEU . 6.0 mt -138.81 143.83 31.13 Favored 'Isoleucine or valine' 0 CA--C 1.481 -1.709 0 O-C-N 120.899 -1.126 . . . . 0.0 110.811 178.054 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.48 ' HA ' HD23 ' A' ' 91' ' ' LEU . 57.5 mt -106.24 128.11 53.72 Favored 'General case' 0 N--CA 1.404 -2.738 0 CA-C-N 114.183 -1.371 . . . . 0.0 111.838 177.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -115.92 149.75 43.8 Favored Pre-proline 0 C--N 1.272 -2.799 0 CA-C-N 113.064 -1.88 . . . . 0.0 106.236 -178.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.486 ' HG2' ' HB3' ' A' ' 19' ' ' LEU . 38.8 Cg_exo -65.36 169.13 12.97 Favored 'Trans proline' 0 N--CA 1.439 -1.679 0 N-CA-C 107.782 -1.661 . . . . 0.0 107.782 168.071 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 10.4 m -40.38 -47.96 2.64 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 123.928 0.767 . . . . 0.0 110.633 172.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -68.06 -39.8 82.93 Favored 'General case' 0 C--O 1.208 -1.129 0 CA-C-N 114.637 -1.165 . . . . 0.0 112.047 -175.054 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.475 ' O ' ' HG ' ' A' ' 100' ' ' LEU . . . -61.19 -52.89 48.96 Favored Glycine 0 N--CA 1.433 -1.518 0 N-CA-C 110.619 -0.992 . . . . 0.0 110.619 -178.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.545 ' HB2' ' HB2' ' A' ' 31' ' ' TYR . 69.5 t-105 -55.66 -53.33 57.81 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 123.596 0.758 . . . . 0.0 110.273 174.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 97.0 m-20 -46.86 -41.47 15.77 Favored 'General case' 0 C--O 1.199 -1.591 0 C-N-CA 123.349 0.66 . . . . 0.0 111.688 176.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.436 ' HB2' ' O ' ' A' ' 96' ' ' GLY . 41.6 mttm -64.46 -53.88 41.34 Favored 'General case' 0 CA--C 1.477 -1.862 0 CA-C-O 121.553 0.692 . . . . 0.0 109.989 -178.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 96' ' ' GLY . 77.8 mt -65.53 -33.42 75.88 Favored 'General case' 0 C--N 1.265 -3.096 0 CA-C-N 114.502 -1.226 . . . . 0.0 112.694 -176.148 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.428 ' O ' ' HA ' ' A' ' 105' ' ' THR . 48.1 t -79.64 -25.81 12.37 Favored 'Isoleucine or valine' 0 N--CA 1.4 -2.956 0 CA-C-O 121.494 0.664 . . . . 0.0 110.864 176.04 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 62.4 m -76.2 -38.04 57.01 Favored 'General case' 0 N--CA 1.419 -1.998 0 O-C-N 121.189 -0.944 . . . . 0.0 109.621 175.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' TRP . . . . . 0.406 ' CE3' HD23 ' A' ' 100' ' ' LEU . 28.8 m0 -82.17 -44.13 16.82 Favored 'General case' 0 N--CA 1.435 -1.215 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.424 -177.295 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' TYR . . . . . 0.412 ' O ' ' HA ' ' A' ' 64' ' ' PRO . 36.7 m-85 -119.95 -12.12 9.2 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -172.431 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.428 ' HA ' ' O ' ' A' ' 101' ' ' VAL 0.333 11.7 t 53.63 -174.44 0.03 OUTLIER 'General case' 0 C--O 1.24 0.604 0 C-N-CA 126.501 1.92 . . . . 0.0 114.009 -172.9 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -105.32 148.33 27.16 Favored 'General case' 0 C--N 1.248 -3.848 0 CA-C-N 113.425 -1.716 . . . . 0.0 109.212 -171.694 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . 0.428 ' HG3' ' HB2' ' A' ' 66' ' ' ASP . 68.4 mmm -73.13 156.92 38.16 Favored 'General case' 0 CA--C 1.504 -0.822 0 CA-C-O 120.926 0.393 . . . . 0.0 111.503 175.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -61.17 148.37 40.99 Favored 'General case' 0 C--N 1.31 -1.12 0 C-N-CA 124.55 1.14 . . . . 0.0 112.011 -179.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 78.49 -23.89 2.77 Favored Glycine 0 N--CA 1.432 -1.588 0 CA-C-N 114.535 -1.212 . . . . 0.0 113.551 175.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -85.37 159.39 20.01 Favored 'General case' 0 N--CA 1.426 -1.661 0 CA-C-O 121.672 0.748 . . . . 0.0 111.175 -176.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -134.98 156.03 78.73 Favored Pre-proline 0 C--N 1.273 -2.743 0 N-CA-C 106.303 -1.74 . . . . 0.0 106.303 175.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -58.36 122.44 11.68 Favored 'Trans proline' 0 CA--C 1.469 -2.726 0 C-N-CA 122.431 2.088 . . . . 0.0 111.159 176.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.53 ' HB ' ' HB3' ' A' ' 32' ' ' LEU . 63.0 mt -84.42 106.63 14.8 Favored 'Isoleucine or valine' 0 N--CA 1.381 -3.879 0 CA-C-N 113.028 -1.896 . . . . 0.0 106.933 179.085 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -94.74 125.76 39.61 Favored 'General case' 0 C--N 1.27 -2.883 0 CA-C-O 121.725 0.774 . . . . 0.0 110.377 -179.451 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 10.1 tpt180 -125.72 115.05 19.47 Favored 'General case' 0 N--CA 1.4 -2.952 0 N-CA-C 105.31 -2.107 . . . . 0.0 105.31 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -73.53 166.19 23.69 Favored 'General case' 0 C--N 1.274 -2.683 0 C-N-CA 120.37 -0.532 . . . . 0.0 111.103 -179.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 87.3 t . . . . . 0 C--O 1.242 0.677 0 O-C-N 124.0 0.813 . . . . 0.0 109.595 178.758 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.491 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . . . . . . 0 N--CA 1.435 -1.216 0 CA-C-O 120.652 0.263 . . . . 0.0 110.806 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.693 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 25.0 t70 -70.58 146.27 50.21 Favored 'General case' 0 CA--C 1.465 -2.299 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 174.545 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.496 ' O ' ' HG2' ' A' ' 13' ' ' ARG . 28.5 mt -53.79 -43.88 69.67 Favored 'General case' 0 CA--C 1.487 -1.454 0 CA-C-N 119.085 0.857 . . . . 0.0 111.166 -177.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -68.24 -24.19 64.88 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 114.897 -1.047 . . . . 0.0 110.094 -176.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.583 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 5.1 m -78.79 -50.77 10.75 Favored 'General case' 0 N--CA 1.38 -3.931 0 CA-C-N 114.498 -1.228 . . . . 0.0 109.462 175.092 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.693 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 52.0 mt-30 -49.16 -61.12 2.25 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.966 0.906 . . . . 0.0 112.298 -175.42 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.496 ' HG2' ' O ' ' A' ' 9' ' ' LEU . 1.6 ptm180 -49.05 -43.43 40.79 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-O 121.701 0.763 . . . . 0.0 112.356 177.619 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.4 m -75.32 -34.6 61.25 Favored 'General case' 0 C--N 1.278 -2.534 0 CA-C-N 114.549 -1.205 . . . . 0.0 112.493 -176.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.5 t0 -77.08 -36.74 55.55 Favored 'General case' 0 C--N 1.3 -1.582 0 C-N-CA 123.786 0.834 . . . . 0.0 109.628 -177.01 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.61 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 27.3 mm -73.12 -33.05 41.13 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.244 0 C-N-CA 123.235 0.614 . . . . 0.0 110.468 177.056 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.34 -36.46 71.19 Favored 'General case' 0 CA--C 1.502 -0.89 0 O-C-N 123.855 0.722 . . . . 0.0 109.092 -178.019 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.549 ' O ' ' HG3' ' A' ' 21' ' ' LYS . 24.7 m -54.15 -57.12 12.32 Favored 'General case' 0 N--CA 1.405 -2.708 0 C-N-CA 125.757 1.623 . . . . 0.0 111.096 177.663 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.518 ' HB3' ' HD2' ' A' ' 93' ' ' PRO . 2.7 mm? -66.81 -18.05 65.19 Favored 'General case' 1 N--CA 1.377 -4.099 0 N-CA-C 114.63 1.345 . . . . 0.0 114.63 -178.213 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.61 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 10.0 mt -84.43 -26.08 28.53 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-O 121.64 0.733 . . . . 0.0 109.442 178.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.549 ' HG3' ' O ' ' A' ' 18' ' ' THR . 0.0 OUTLIER -91.86 -7.57 48.95 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-N 114.667 -1.152 . . . . 0.0 110.822 -173.628 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 51.9 m -71.25 139.07 49.91 Favored 'General case' 0 N--CA 1.394 -3.275 0 CA-C-N 113.354 -1.748 . . . . 0.0 111.138 177.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 73.7 m -87.3 132.22 34.0 Favored 'General case' 0 N--CA 1.389 -3.501 0 CA-C-N 113.777 -1.556 . . . . 0.0 109.61 176.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.659 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP . 0.6 OUTLIER -80.21 160.09 25.73 Favored 'General case' 0 C--N 1.296 -1.756 0 N-CA-C 114.21 1.189 . . . . 0.0 114.21 -176.969 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.433 ' O ' HG21 ' A' ' 117' ' ' VAL . 0.0 OUTLIER -101.74 144.08 30.88 Favored 'General case' 0 C--N 1.295 -1.802 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 177.348 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -54.51 -22.2 12.24 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 116.649 2.092 . . . . 0.0 116.649 -169.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -134.7 33.53 2.47 Favored Glycine 0 C--N 1.293 -1.808 0 N-CA-C 110.409 -1.076 . . . . 0.0 110.409 -179.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.421 ' HB2' ' HB2' ' A' ' 25' ' ' ARG . 2.5 t70 -85.54 -177.17 6.36 Favored 'General case' 0 C--N 1.315 -0.933 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.285 -178.212 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.515 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 85.6 m -129.04 121.67 28.39 Favored 'General case' 0 N--CA 1.438 -1.061 0 CA-C-O 121.375 0.607 . . . . 0.0 110.249 -177.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.659 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 15.2 m95 -113.31 148.97 34.62 Favored 'General case' 0 N--CA 1.424 -1.767 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.35 -179.043 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.405 ' HB2' ' HB2' ' A' ' 97' ' ' TRP . 86.7 m-85 -106.68 142.68 35.94 Favored 'General case' 0 C--N 1.292 -1.922 0 C-N-CA 123.07 0.548 . . . . 0.0 111.385 -175.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.633 HD13 HG22 ' A' ' 113' ' ' ILE . 6.2 mp -93.17 133.18 36.62 Favored 'General case' 0 CA--C 1.496 -1.096 0 CA-C-O 122.184 0.992 . . . . 0.0 113.606 -177.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.439 HG12 ' O ' ' A' ' 34' ' ' ASP . 53.4 t -117.06 142.45 30.89 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.484 0 N-CA-C 104.845 -2.28 . . . . 0.0 104.845 174.046 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.439 ' O ' HG12 ' A' ' 33' ' ' VAL . 4.5 t0 -67.28 127.7 33.65 Favored 'General case' 0 C--N 1.288 -2.078 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 172.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 6.5 t -66.46 -30.16 70.44 Favored 'General case' 0 N--CA 1.423 -1.789 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 -174.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 47.1 mtp85 -71.52 -29.78 65.17 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.149 -176.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.445 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 70.6 t90 -69.6 -46.96 65.09 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 173.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.492 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 28.9 t80 -61.53 -41.88 97.99 Favored 'General case' 0 C--O 1.212 -0.886 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.075 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.495 ' HA ' ' HE3' ' A' ' 42' ' ' LYS . 0.1 OUTLIER -55.5 -41.2 72.75 Favored 'General case' 0 N--CA 1.439 -1.004 0 O-C-N 122.007 -0.433 . . . . 0.0 111.855 175.091 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.445 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 21.5 tp60 -65.45 -42.38 92.4 Favored 'General case' 0 N--CA 1.423 -1.81 0 C-N-CA 123.495 0.718 . . . . 0.0 109.698 176.45 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 65.2 t90 -61.1 -39.98 92.01 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.592 177.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.495 ' HE3' ' HA ' ' A' ' 39' ' ' LYS . 8.3 mtmp? -56.99 -42.81 80.93 Favored 'General case' 0 CA--C 1.495 -1.17 0 CA-C-N 117.948 0.34 . . . . 0.0 110.991 -179.691 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.514 ' HB3' ' HB2' ' A' ' 54' ' ' GLN . 93.5 mttt -58.63 -52.14 66.95 Favored 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 124.175 0.922 . . . . 0.0 109.283 178.37 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.528 ' HB2' HG23 ' A' ' 60' ' ' VAL . 0.4 OUTLIER -65.55 -41.13 93.34 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-N 114.175 -1.375 . . . . 0.0 112.482 -172.48 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.423 ' CG1' ' HB2' ' A' ' 47' ' ' PHE . 3.7 p -90.47 -12.72 9.44 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.721 0 CA-C-N 116.313 -0.403 . . . . 0.0 112.026 -175.678 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.776 ' HA2' ' HB2' ' A' ' 52' ' ' LYS . . . 64.23 45.32 93.89 Favored Glycine 0 N--CA 1.4 -3.72 0 C-N-CA 121.183 -0.532 . . . . 0.0 112.689 -171.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.423 ' HB2' ' CG1' ' A' ' 45' ' ' VAL . 94.5 t80 -66.44 -52.94 41.11 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 123.607 0.763 . . . . 0.0 112.002 -178.254 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.468 ' OD1' ' HB3' ' A' ' 42' ' ' LYS . 16.5 p-10 -99.08 99.64 10.68 Favored 'General case' 0 C--N 1.289 -2.051 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.923 -176.074 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 8.9 m -49.8 -29.73 8.41 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 125.547 1.539 . . . . 0.0 114.158 -176.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.432 ' CE2' ' HB2' ' A' ' 48' ' ' ASP . 49.1 p90 -72.56 -11.66 60.74 Favored 'General case' 0 C--N 1.322 -0.589 0 O-C-N 122.044 -0.41 . . . . 0.0 111.428 179.377 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.437 ' O ' ' HD2' ' A' ' 52' ' ' LYS . 20.1 t70 -129.26 -94.34 0.42 Allowed 'General case' 0 C--N 1.304 -1.387 0 CA-C-O 118.508 -0.758 . . . . 0.0 109.769 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.776 ' HB2' ' HA2' ' A' ' 46' ' ' GLY . 0.0 OUTLIER 42.8 29.11 0.15 Allowed 'General case' 0 CA--C 1.554 1.12 0 N-CA-C 116.392 1.997 . . . . 0.0 116.392 172.087 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.422 ' HD1' ' H ' ' A' ' 53' ' ' TYR . 1.6 p90 -63.82 -5.08 3.77 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 115.407 1.632 . . . . 0.0 115.407 -173.343 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.514 ' HB2' ' HB3' ' A' ' 43' ' ' LYS . 11.2 mm100 -128.1 23.86 6.03 Favored 'General case' 0 C--N 1.285 -2.213 0 C-N-CA 124.015 0.926 . . . . 0.0 110.651 -171.321 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 50.4 ttm -57.0 108.26 0.49 Allowed 'General case' 0 N--CA 1.437 -1.098 0 C-N-CA 124.052 0.941 . . . . 0.0 110.784 -179.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.27 16.84 73.14 Favored Glycine 0 N--CA 1.434 -1.464 0 CA-C-N 115.855 -0.611 . . . . 0.0 112.299 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.552 ' HB3' HG22 ' A' ' 60' ' ' VAL . 7.6 t0 -86.97 148.56 25.27 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 178.405 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.464 ' O ' ' HD1' ' A' ' 61' ' ' TYR . 28.6 pt20 -85.19 -23.26 28.41 Favored 'General case' 0 C--N 1.292 -1.931 0 CA-C-O 121.493 0.663 . . . . 0.0 111.287 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 -62.04 -18.16 59.73 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-O 121.93 0.871 . . . . 0.0 111.699 -179.309 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.552 HG22 ' HB3' ' A' ' 57' ' ' ASP . 29.3 m -116.64 8.22 7.22 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.098 0 CA-C-N 115.028 -0.987 . . . . 0.0 112.225 -173.154 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.464 ' HD1' ' O ' ' A' ' 58' ' ' GLN . 2.8 p90 -60.37 116.85 19.62 Favored Pre-proline 0 C--N 1.308 -1.215 0 O-C-N 124.215 0.947 . . . . 0.0 110.681 -179.484 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 61' ' ' TYR . 7.7 Cg_endo -89.94 110.48 0.43 Allowed 'Trans proline' 0 N--CA 1.42 -2.818 0 C-N-CA 122.695 2.264 . . . . 0.0 109.39 175.411 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -69.66 -146.79 0.26 Allowed Glycine 0 C--N 1.291 -1.935 0 CA-C-N 115.03 -0.986 . . . . 0.0 112.879 177.307 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.637 ' HA ' ' O ' ' A' ' 104' ' ' TYR . 32.8 Cg_exo -55.34 134.47 64.06 Favored 'Trans proline' 0 C--O 1.247 0.94 0 C-N-CA 122.778 2.319 . . . . 0.0 112.2 -177.167 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.447 HD11 ' HB3' ' A' ' 100' ' ' LEU . 78.9 mt -62.29 125.14 18.12 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.039 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.433 -178.216 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.474 ' HB3' ' SD ' ' A' ' 107' ' ' MET . 7.1 p-10 -108.38 122.37 46.86 Favored 'General case' 0 N--CA 1.407 -2.602 0 CA-C-O 122.247 1.022 . . . . 0.0 109.222 177.797 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.567 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 13.4 m120 -100.52 9.65 42.26 Favored 'General case' 0 C--N 1.279 -2.47 0 N-CA-C 107.189 -1.412 . . . . 0.0 107.189 171.182 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 6.0 m -57.28 -34.25 68.47 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 124.965 1.306 . . . . 0.0 111.12 -178.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -77.91 -13.01 83.86 Favored Glycine 0 N--CA 1.438 -1.171 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.272 178.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 36.6 mt -100.03 -14.77 18.49 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 179.446 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.567 ' HG ' ' O ' ' A' ' 67' ' ' ASN . 99.6 mt -80.43 139.19 36.58 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.863 -178.426 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt . . . . . 0 C--N 1.309 -1.168 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.581 175.235 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.464 ' HA ' HD13 ' A' ' 71' ' ' LEU . . . . . . . . 0 N--CA 1.437 -1.083 0 CA-C-O 121.898 0.856 . . . . 0.0 109.254 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 56.8 mm-40 -118.66 -2.63 10.93 Favored 'General case' 0 C--N 1.299 -1.61 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 24.2 p -90.87 116.89 29.04 Favored 'General case' 0 N--CA 1.424 -1.764 0 CA-C-N 113.854 -1.521 . . . . 0.0 109.729 -177.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 19.1 tp -98.29 138.86 34.93 Favored 'General case' 0 N--CA 1.39 -3.444 0 C-N-CA 124.371 1.068 . . . . 0.0 110.068 -176.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.465 ' CB ' HD13 ' A' ' 83' ' ' LEU . 68.3 mttm -61.31 139.09 58.23 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.556 0.693 . . . . 0.0 111.26 177.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -89.28 -19.51 25.25 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-N 114.722 -1.126 . . . . 0.0 113.918 -168.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 28.5 m170 -86.28 -10.98 53.47 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -175.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.465 HD13 ' CB ' ' A' ' 80' ' ' LYS . 8.2 mp -76.77 139.2 40.32 Favored 'General case' 0 C--N 1.295 -1.768 0 N-CA-C 114.948 1.462 . . . . 0.0 114.948 -172.297 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.615 HG21 HD12 ' A' ' 87' ' ' LEU . 58.0 mt -101.05 178.06 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.426 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 176.339 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.719 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 12.2 t70 -64.87 -130.72 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.557 0 C-N-CA 124.372 1.069 . . . . 0.0 110.186 -177.295 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.42 ' HA ' ' O ' ' A' ' 89' ' ' TYR . 6.8 tp10 -38.43 -24.08 0.01 OUTLIER 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 127.585 2.354 . . . . 0.0 114.792 -179.192 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.615 HD12 HG21 ' A' ' 84' ' ' ILE . 18.6 mt -66.43 -47.5 73.03 Favored 'General case' 0 C--N 1.284 -2.28 0 C-N-CA 123.33 0.652 . . . . 0.0 110.821 177.159 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -113.63 -34.28 5.58 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.41 -175.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' TYR . . . . . 0.719 ' CE1' ' HA ' ' A' ' 85' ' ' ASP . 3.7 p90 -142.41 -163.87 1.7 Allowed 'General case' 0 C--O 1.187 -2.227 0 N-CA-C 106.315 -1.735 . . . . 0.0 106.315 -179.433 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.564 ' O ' ' HA ' ' A' ' 32' ' ' LEU . 4.7 mt -147.68 148.2 16.6 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.235 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 171.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.541 HD21 ' CD1' ' A' ' 32' ' ' LEU . 26.6 mt -109.81 126.2 53.54 Favored 'General case' 0 N--CA 1.397 -3.113 0 O-C-N 124.532 1.145 . . . . 0.0 111.476 175.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.411 HD23 HG23 ' A' ' 33' ' ' VAL . 1.6 mm? -118.86 149.51 46.74 Favored Pre-proline 0 C--N 1.306 -1.317 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.686 -177.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.518 ' HD2' ' HB3' ' A' ' 19' ' ' LEU . 50.0 Cg_exo -61.71 168.67 8.14 Favored 'Trans proline' 0 C--O 1.257 1.465 0 C-N-CA 122.051 1.834 . . . . 0.0 108.51 164.626 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 19.5 m -46.79 -41.01 14.74 Favored 'General case' 0 C--N 1.306 -1.321 0 O-C-N 123.607 0.567 . . . . 0.0 111.05 174.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 5.8 mp0 -61.96 -52.7 62.95 Favored 'General case' 0 CA--C 1.5 -0.95 0 C-N-CA 124.538 1.135 . . . . 0.0 111.046 -178.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.478 ' O ' ' HG ' ' A' ' 100' ' ' LEU . . . -56.07 -54.28 36.6 Favored Glycine 0 N--CA 1.429 -1.795 0 O-C-N 124.015 0.822 . . . . 0.0 111.848 -176.456 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.405 ' HB2' ' HB2' ' A' ' 31' ' ' TYR . 70.9 t-105 -55.65 -51.09 68.38 Favored 'General case' 0 N--CA 1.425 -1.724 0 C-N-CA 123.007 0.523 . . . . 0.0 111.312 176.148 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 -52.37 -34.97 50.21 Favored 'General case' 0 CA--C 1.485 -1.533 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 177.071 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.447 ' HB2' ' O ' ' A' ' 96' ' ' GLY . 54.2 mttm -67.01 -52.11 46.51 Favored 'General case' 0 CA--C 1.468 -2.21 0 CA-C-O 121.375 0.607 . . . . 0.0 110.419 178.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 96' ' ' GLY . 69.1 mt -65.99 -35.92 81.89 Favored 'General case' 0 C--N 1.261 -3.25 0 CA-C-N 114.752 -1.113 . . . . 0.0 111.945 -175.683 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.497 ' HA ' ' HA ' ' A' ' 105' ' ' THR . 18.6 t -77.59 -25.41 14.8 Favored 'Isoleucine or valine' 0 N--CA 1.399 -2.995 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.723 174.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 38.2 t -74.46 -38.22 63.02 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 176.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' TRP . . . . . 0.497 ' CZ3' ' HB3' ' A' ' 12' ' ' GLN . 36.7 m0 -77.85 -54.56 6.18 Favored 'General case' 0 N--CA 1.422 -1.834 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.201 -176.022 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' TYR . . . . . 0.637 ' O ' ' HA ' ' A' ' 64' ' ' PRO . 30.9 m-85 -127.88 13.21 6.82 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 114.255 1.206 . . . . 0.0 114.255 -175.505 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' A' ' 101' ' ' VAL 0.252 10.0 t 47.28 -170.05 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 126.256 1.822 . . . . 0.0 115.473 178.755 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 52.6 tp -115.39 142.15 47.08 Favored 'General case' 0 C--N 1.26 -3.309 0 CA-C-N 113.29 -1.777 . . . . 0.0 109.006 -175.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . 0.474 ' SD ' ' HB3' ' A' ' 66' ' ' ASP . 72.9 mtp -63.18 156.37 25.44 Favored 'General case' 0 CA--C 1.508 -0.656 0 CA-C-O 122.155 0.979 . . . . 0.0 113.621 178.6 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -71.53 147.66 47.5 Favored 'General case' 0 N--CA 1.413 -2.32 0 CA-C-N 113.967 -1.469 . . . . 0.0 111.533 178.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 94.76 -24.48 27.93 Favored Glycine 0 N--CA 1.418 -2.545 0 CA-C-N 114.926 -1.034 . . . . 0.0 113.504 175.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -113.65 169.86 8.67 Favored 'General case' 0 N--CA 1.421 -1.914 0 CA-C-O 120.698 0.285 . . . . 0.0 110.501 -177.217 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 65.8 mm-40 -137.1 155.57 76.01 Favored Pre-proline 0 C--N 1.301 -1.503 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 -177.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_exo -56.62 124.57 16.57 Favored 'Trans proline' 0 CA--C 1.463 -3.047 0 C-N-CA 123.498 2.798 . . . . 0.0 113.012 -177.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.633 HG22 HD13 ' A' ' 32' ' ' LEU . 2.6 mp -83.36 110.21 17.96 Favored 'Isoleucine or valine' 0 N--CA 1.384 -3.755 0 N-CA-C 106.534 -1.654 . . . . 0.0 106.534 175.292 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . 0.515 ' HB1' ' CG2' ' A' ' 29' ' ' THR . . . -107.13 132.85 52.56 Favored 'General case' 0 C--N 1.281 -2.387 0 CA-C-N 115.426 -0.806 . . . . 0.0 108.901 178.515 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.549 ' HB2' HD11 ' A' ' 32' ' ' LEU . 5.4 tpt180 -130.33 135.24 47.85 Favored 'General case' 0 N--CA 1.407 -2.616 0 N-CA-C 105.706 -1.961 . . . . 0.0 105.706 -178.505 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -84.23 168.58 15.6 Favored 'General case' 0 C--N 1.272 -2.792 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -175.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.433 HG21 ' O ' ' A' ' 25' ' ' ARG . 90.4 t . . . . . 0 N--CA 1.42 -1.967 0 CA-C-O 122.376 1.084 . . . . 0.0 111.177 -177.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.541 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . . . . . . 0 C--O 1.248 1.026 0 CA-C-O 120.92 0.391 . . . . 0.0 111.213 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.607 ' O ' ' HB ' ' A' ' 11' ' ' THR . 19.6 t70 -78.37 157.55 29.04 Favored 'General case' 0 C--O 1.178 -2.7 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 176.327 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.471 ' O ' ' HG3' ' A' ' 13' ' ' ARG . 32.5 mt -59.1 -33.89 71.36 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 118.945 0.793 . . . . 0.0 111.608 -177.065 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.409 ' HA ' ' NH1' ' A' ' 13' ' ' ARG . 18.4 t70 -73.13 -30.0 63.3 Favored 'General case' 0 C--N 1.281 -2.396 0 CA-C-N 114.003 -1.453 . . . . 0.0 108.965 -178.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.607 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 56.2 m -78.12 -49.74 13.33 Favored 'General case' 0 N--CA 1.382 -3.837 0 CA-C-N 113.887 -1.506 . . . . 0.0 110.233 177.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.521 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 25.7 mt-30 -55.42 -57.29 12.47 Favored 'General case' 0 C--N 1.346 0.443 0 C-N-CA 123.171 0.588 . . . . 0.0 112.132 -172.243 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.607 ' HG2' HG13 ' A' ' 45' ' ' VAL . 42.4 mtm-85 -44.64 -54.28 6.32 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-O 121.698 0.761 . . . . 0.0 109.896 177.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 59.7 m -65.63 -48.92 70.59 Favored 'General case' 0 N--CA 1.419 -2.004 0 CA-C-N 113.467 -1.697 . . . . 0.0 112.732 -172.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -66.54 -35.27 79.82 Favored 'General case' 0 C--N 1.314 -0.977 0 C-N-CA 124.169 0.988 . . . . 0.0 109.841 -175.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 30.4 mm -77.67 -44.53 29.17 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.303 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.769 176.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.15 -35.87 67.65 Favored 'General case' 0 CA--C 1.493 -1.239 0 CA-C-O 121.349 0.595 . . . . 0.0 109.558 -176.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 3.0 m -54.87 -42.77 72.47 Favored 'General case' 0 N--CA 1.394 -3.266 0 C-N-CA 126.017 1.727 . . . . 0.0 112.069 177.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.568 HD11 ' HE3' ' A' ' 99' ' ' LYS . 64.4 mt -83.7 -23.48 31.67 Favored 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -171.321 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.92 -26.46 68.32 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 122.046 0.927 . . . . 0.0 109.999 170.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -91.22 -36.15 14.1 Favored 'General case' 0 C--N 1.29 -1.984 0 CA-C-N 114.081 -1.418 . . . . 0.0 110.633 -173.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 93.5 m -47.35 139.32 6.57 Favored 'General case' 0 N--CA 1.409 -2.515 0 C-N-CA 125.086 1.354 . . . . 0.0 111.697 173.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.2 t -90.57 166.27 13.3 Favored 'General case' 0 N--CA 1.41 -2.444 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.001 -172.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.532 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP . 0.5 OUTLIER -119.23 166.43 12.99 Favored 'General case' 0 N--CA 1.413 -2.297 0 CA-C-N 115.018 -0.992 . . . . 0.0 113.443 -179.105 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.478 ' O ' HG21 ' A' ' 117' ' ' VAL . 32.7 mmm180 -139.07 138.72 37.36 Favored 'General case' 0 CA--C 1.489 -1.399 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 179.354 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -62.22 109.65 1.38 Allowed 'General case' 0 C--N 1.301 -1.513 0 CA-C-O 121.994 0.902 . . . . 0.0 113.227 -177.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 128.44 -16.86 5.92 Favored Glycine 0 N--CA 1.423 -2.177 0 CA-C-N 113.854 -1.521 . . . . 0.0 110.01 -174.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 39.2 t0 -73.16 155.58 39.48 Favored 'General case' 0 CA--C 1.502 -0.897 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 18.6 m -115.83 123.88 49.28 Favored 'General case' 0 C--N 1.28 -2.456 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 -177.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.532 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 15.9 m95 -112.97 162.36 15.95 Favored 'General case' 0 C--N 1.285 -2.198 0 N-CA-C 107.707 -1.22 . . . . 0.0 107.707 178.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.463 ' CD1' ' HA ' ' A' ' 94' ' ' THR . 52.2 m-85 -117.56 141.93 47.78 Favored 'General case' 0 C--N 1.274 -2.694 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.679 ' HA ' ' O ' ' A' ' 90' ' ' ILE 0.414 0.4 OUTLIER -106.36 132.05 52.85 Favored 'General case' 0 N--CA 1.424 -1.741 0 N-CA-C 114.385 1.254 . . . . 0.0 114.385 179.525 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.438 HG12 ' O ' ' A' ' 34' ' ' ASP . 89.9 t -110.49 151.21 12.74 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.485 0 CA-C-N 112.403 -2.18 . . . . 0.0 106.4 -176.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.499 ' OD1' ' HG2' ' A' ' 36' ' ' ARG . 18.7 t0 -72.91 131.69 42.53 Favored 'General case' 0 C--N 1.296 -1.723 0 N-CA-C 106.895 -1.521 . . . . 0.0 106.895 171.411 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.4 t -71.94 -22.7 61.43 Favored 'General case' 0 N--CA 1.422 -1.864 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 -171.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.564 HH11 ' HG2' ' A' ' 36' ' ' ARG . 9.3 mmt-85 -70.49 -36.91 74.08 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.413 -177.346 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.416 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 71.5 t90 -70.94 -43.19 68.67 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 178.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.521 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 41.3 t80 -61.29 -41.83 97.63 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.096 179.024 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.48 ' HA ' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -53.03 -45.58 68.06 Favored 'General case' 0 N--CA 1.425 -1.682 0 C-N-CA 122.426 0.29 . . . . 0.0 111.183 174.106 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.438 ' NE2' ' HD3' ' A' ' 43' ' ' LYS . 25.5 tp60 -64.09 -39.49 94.17 Favored 'General case' 0 N--CA 1.426 -1.661 0 C-N-CA 124.059 0.944 . . . . 0.0 110.74 179.039 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 65.6 t90 -61.35 -38.08 85.67 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.847 176.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.521 ' HG3' ' O ' ' A' ' 38' ' ' PHE . 33.1 mtmt -59.15 -41.06 87.45 Favored 'General case' 0 CA--C 1.5 -0.971 0 CA-C-O 120.712 0.291 . . . . 0.0 111.268 -179.049 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.537 ' HG2' ' OD2' ' A' ' 51' ' ' ASP . 18.5 mtpp -66.94 -36.58 82.55 Favored 'General case' 0 C--N 1.311 -1.109 0 CA-C-N 115.101 -0.954 . . . . 0.0 108.818 -176.416 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.634 ' O ' ' HA ' ' A' ' 55' ' ' MET . 0.1 OUTLIER -79.37 -36.46 39.22 Favored 'General case' 0 N--CA 1.436 -1.129 0 CA-C-N 114.504 -1.225 . . . . 0.0 111.876 -177.885 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.607 HG13 ' HG2' ' A' ' 13' ' ' ARG . 3.5 p -89.29 -18.63 7.75 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.087 0 O-C-N 121.973 -0.454 . . . . 0.0 111.896 -177.087 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.625 ' HA2' ' HB2' ' A' ' 52' ' ' LYS . . . 81.93 34.11 25.16 Favored Glycine 0 N--CA 1.428 -1.887 0 N-CA-C 111.924 -0.47 . . . . 0.0 111.924 -176.363 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.419 ' HB3' ' HB3' ' A' ' 42' ' ' LYS . 35.6 t80 -68.86 -42.43 77.08 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 123.055 0.542 . . . . 0.0 110.204 -179.341 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -86.96 126.43 34.71 Favored 'General case' 0 CA--C 1.498 -1.056 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 177.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.3 m -60.3 -36.26 77.47 Favored 'General case' 0 C--N 1.304 -1.38 0 CA-C-O 121.014 0.435 . . . . 0.0 112.079 -178.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 45.5 p90 -91.36 -7.67 50.2 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.586 -177.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.537 ' OD2' ' HG2' ' A' ' 43' ' ' LYS . 28.7 t70 -136.88 85.44 2.14 Favored 'General case' 0 CA--C 1.485 -1.552 0 CA-C-O 122.014 0.911 . . . . 0.0 110.439 -177.168 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.625 ' HB2' ' HA2' ' A' ' 46' ' ' GLY . 64.3 pttt -160.5 13.05 0.11 Allowed 'General case' 0 N--CA 1.432 -1.362 0 CA-C-N 113.73 -1.577 . . . . 0.0 112.768 -173.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 43.2 m-85 -68.64 -3.86 13.43 Favored 'General case' 0 C--N 1.287 -2.125 0 CA-C-O 121.932 0.872 . . . . 0.0 109.254 176.405 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.487 HE21 ' HE3' ' A' ' 43' ' ' LYS . 0.4 OUTLIER -112.45 17.34 19.38 Favored 'General case' 0 N--CA 1.403 -2.79 0 CA-C-N 114.887 -1.051 . . . . 0.0 109.47 -177.309 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . 0.634 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 51.6 ttp -62.83 105.11 0.62 Allowed 'General case' 0 N--CA 1.413 -2.289 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.561 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 74.99 29.31 60.94 Favored Glycine 0 N--CA 1.437 -1.269 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.124 -176.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -102.79 154.25 19.36 Favored 'General case' 0 N--CA 1.444 -0.732 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 -177.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 29.7 pt20 -83.27 -17.26 43.2 Favored 'General case' 0 C--N 1.301 -1.525 0 CA-C-O 121.709 0.766 . . . . 0.0 109.986 -177.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 28.0 m-80 -61.18 -24.01 66.0 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 114.784 -1.098 . . . . 0.0 111.959 179.05 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 22.2 m -117.61 -21.4 4.85 Favored 'Isoleucine or valine' 0 CA--C 1.457 -2.633 0 N-CA-C 113.094 0.776 . . . . 0.0 113.094 -176.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . 0.311 2.4 p90 -33.73 102.38 0.21 Allowed Pre-proline 0 CA--C 1.545 0.766 0 O-C-N 126.179 2.174 . . . . 0.0 114.901 -159.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -75.15 102.44 1.59 Allowed 'Trans proline' 0 N--CA 1.426 -2.469 0 C-N-CA 122.9 2.4 . . . . 0.0 110.384 176.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -73.42 -144.12 0.68 Allowed Glycine 0 C--N 1.28 -2.555 0 CA-C-N 114.078 -1.419 . . . . 0.0 112.624 176.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_exo -56.98 133.57 58.82 Favored 'Trans proline' 0 C--O 1.246 0.897 0 C-N-CA 122.926 2.417 . . . . 0.0 112.417 -177.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.534 HD11 ' HB3' ' A' ' 100' ' ' LEU . 54.8 mt -62.16 114.02 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.361 0 CA-C-N 114.966 -1.016 . . . . 0.0 110.47 -177.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.473 ' HB2' ' SD ' ' A' ' 107' ' ' MET . 7.9 t70 -97.98 113.94 25.93 Favored 'General case' 0 CA--C 1.489 -1.381 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 173.463 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.444 ' O ' HD23 ' A' ' 71' ' ' LEU . 13.6 m120 -89.85 -15.06 33.04 Favored 'General case' 0 C--N 1.286 -2.167 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.672 178.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 6.0 m -53.03 -18.2 1.91 Allowed 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 114.995 1.479 . . . . 0.0 114.995 -168.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -76.65 -3.01 77.87 Favored Glycine 0 CA--C 1.527 0.81 0 C-N-CA 120.932 -0.651 . . . . 0.0 113.107 -178.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.423 HD21 ' HA ' ' A' ' 34' ' ' ASP . 39.5 mt -107.44 -17.39 14.13 Favored 'General case' 0 C--O 1.243 0.734 0 CA-C-O 122.253 1.025 . . . . 0.0 109.335 -179.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.444 HD23 ' O ' ' A' ' 67' ' ' ASN . 2.7 mm? -84.01 163.8 19.71 Favored 'General case' 0 N--CA 1.401 -2.918 0 CA-C-N 113.679 -1.6 . . . . 0.0 112.198 -173.22 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.8 mttt . . . . . 0 C--N 1.301 -1.51 0 CA-C-N 114.527 -1.215 . . . . 0.0 113.444 -178.324 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.5 -0.95 0 CA-C-O 120.936 0.398 . . . . 0.0 110.711 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . 0.712 ' HA ' HE21 ' A' ' 77' ' ' GLN . 0.0 OUTLIER -118.91 -1.2 11.05 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-O 121.809 0.814 . . . . 0.0 109.787 177.591 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 50.5 m -100.66 108.73 20.68 Favored 'General case' 0 C--N 1.281 -2.409 0 CA-C-N 114.407 -1.269 . . . . 0.0 111.137 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 87.1 mt -73.62 153.87 39.99 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.335 -178.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.443 ' HB2' ' CD1' ' A' ' 83' ' ' LEU . 98.9 mttt -78.78 165.83 23.13 Favored 'General case' 0 N--CA 1.426 -1.633 0 C-N-CA 119.734 -0.787 . . . . 0.0 109.202 170.579 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -82.46 -58.87 2.74 Favored 'General case' 0 C--N 1.285 -2.238 0 N-CA-C 113.799 1.037 . . . . 0.0 113.799 -171.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -74.96 12.57 0.83 Allowed 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 116.692 2.108 . . . . 0.0 116.692 -168.253 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.443 ' CD1' ' HB2' ' A' ' 80' ' ' LYS . 8.1 mp -73.78 169.11 18.04 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-O 121.547 0.689 . . . . 0.0 111.884 176.295 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.539 HG21 HD12 ' A' ' 87' ' ' LEU . 48.3 mt -137.33 166.88 24.19 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.575 0 N-CA-C 105.747 -1.945 . . . . 0.0 105.747 -178.013 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.572 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 65.9 t0 -56.24 -142.56 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.405 0 C-N-CA 126.498 1.919 . . . . 0.0 110.082 178.682 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.55 ' HA ' ' O ' ' A' ' 89' ' ' TYR . 7.5 pt-20 -39.09 -19.03 0.01 OUTLIER 'General case' 0 N--CA 1.533 3.694 0 N-CA-C 116.663 2.097 . . . . 0.0 116.663 -172.737 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.539 HD12 HG21 ' A' ' 84' ' ' ILE . 14.5 mt -67.87 -53.95 22.7 Favored 'General case' 0 C--N 1.281 -2.372 0 C-N-CA 123.891 0.876 . . . . 0.0 110.478 175.459 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -108.44 -30.85 8.08 Favored 'General case' 0 C--O 1.216 -0.667 0 CA-C-O 121.4 0.619 . . . . 0.0 110.993 -175.057 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' TYR . . . . . 0.572 ' CE1' ' HA ' ' A' ' 85' ' ' ASP . 8.7 p90 -142.32 -168.81 2.81 Favored 'General case' 0 C--O 1.173 -2.934 0 N-CA-C 104.738 -2.319 . . . . 0.0 104.738 177.542 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.679 ' O ' ' HA ' ' A' ' 32' ' ' LEU . 2.4 mt -144.7 141.07 23.7 Favored 'Isoleucine or valine' 0 CA--C 1.458 -2.578 0 CA-C-N 121.425 1.92 . . . . 0.0 109.47 173.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.502 ' CD2' ' HB3' ' A' ' 32' ' ' LEU . 77.9 mt -107.33 132.03 53.57 Favored 'General case' 0 C--N 1.274 -2.696 0 O-C-N 124.619 1.2 . . . . 0.0 110.792 176.739 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.401 HD12 ' N ' ' A' ' 92' ' ' LEU . 2.1 mp -141.67 156.65 66.15 Favored Pre-proline 0 C--N 1.276 -2.618 0 N-CA-C 106.8 -1.555 . . . . 0.0 106.8 -177.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.412 ' HD2' ' HB3' ' A' ' 19' ' ' LEU . 32.1 Cg_exo -61.23 167.77 8.77 Favored 'Trans proline' 0 C--O 1.26 1.578 0 C-N-CA 122.028 1.819 . . . . 0.0 110.218 174.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.463 ' HA ' ' CD1' ' A' ' 31' ' ' TYR . 32.4 m -49.86 -42.42 47.6 Favored 'General case' 0 C--N 1.306 -1.321 0 O-C-N 123.901 0.751 . . . . 0.0 110.231 176.527 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.492 ' O ' ' HG3' ' A' ' 99' ' ' LYS . 6.3 mm-40 -58.88 -50.34 74.39 Favored 'General case' 0 C--O 1.198 -1.609 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.89 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.581 ' O ' HD22 ' A' ' 100' ' ' LEU . . . -50.45 -58.11 9.49 Favored Glycine 0 CA--C 1.492 -1.362 0 O-C-N 124.153 0.908 . . . . 0.0 111.555 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 66.7 t-105 -54.65 -49.5 70.41 Favored 'General case' 0 C--N 1.311 -1.077 0 C-N-CA 123.169 0.588 . . . . 0.0 110.934 177.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -55.36 -31.11 61.5 Favored 'General case' 0 CA--C 1.496 -1.105 0 C-N-CA 123.088 0.555 . . . . 0.0 112.431 177.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.568 ' HE3' HD11 ' A' ' 19' ' ' LEU . 59.2 mttm -72.82 -51.4 19.04 Favored 'General case' 0 N--CA 1.411 -2.388 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 178.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.581 HD22 ' O ' ' A' ' 96' ' ' GLY . 0.6 OUTLIER -60.7 -39.25 87.83 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.426 0.632 . . . . 0.0 111.153 -179.563 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.551 ' HA ' ' HA ' ' A' ' 105' ' ' THR . 21.3 t -72.89 -28.14 26.32 Favored 'Isoleucine or valine' 0 N--CA 1.403 -2.823 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.774 177.514 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 18.6 t -76.04 -35.45 59.46 Favored 'General case' 0 C--N 1.297 -1.696 0 O-C-N 121.228 -0.92 . . . . 0.0 109.101 178.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' TRP . . . . . 0.54 ' CZ2' ' HB3' ' A' ' 99' ' ' LYS . 28.2 m0 -80.66 -48.44 12.61 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.02 -175.371 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -126.02 -2.14 7.1 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 114.185 1.18 . . . . 0.0 114.185 -177.118 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.551 ' HA ' ' HA ' ' A' ' 101' ' ' VAL 0.351 14.3 t 52.74 175.1 0.02 OUTLIER 'General case' 0 CA--C 1.509 -0.596 0 CA-C-O 123.688 1.708 . . . . 0.0 115.135 -175.59 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 54.4 tp -95.82 160.36 14.51 Favored 'General case' 1 C--N 1.231 -4.553 0 CA-C-N 111.941 -2.39 . . . . 0.0 107.072 -178.023 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . 0.525 ' HG3' ' O ' ' A' ' 65' ' ' ILE . 37.3 mtp -68.62 155.67 39.58 Favored 'General case' 0 CA--C 1.487 -1.479 0 C-N-CA 119.045 -1.062 . . . . 0.0 108.811 175.311 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -84.43 132.53 34.56 Favored 'General case' 0 C--N 1.258 -3.379 0 CA-C-N 115.446 -0.797 . . . . 0.0 113.059 177.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 111.68 -37.37 3.72 Favored Glycine 0 N--CA 1.397 -3.908 0 CA-C-N 114.068 -1.424 . . . . 0.0 110.875 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -93.38 159.69 15.14 Favored 'General case' 0 N--CA 1.422 -1.857 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 178.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . 0.53 ' HB2' ' OE1' ' A' ' 77' ' ' GLN . 45.3 mt-10 -131.65 154.13 81.73 Favored Pre-proline 0 C--N 1.285 -2.223 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 -177.137 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -54.04 142.43 65.46 Favored 'Trans proline' 0 CA--C 1.458 -3.321 0 C-N-CA 124.13 3.22 . . . . 0.0 114.521 -175.264 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.477 ' O ' HD23 ' A' ' 32' ' ' LEU . 2.7 mp -100.51 113.8 37.38 Favored 'Isoleucine or valine' 1 N--CA 1.367 -4.604 0 CA-C-N 113.844 -1.526 . . . . 0.0 107.267 175.035 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -100.09 139.51 35.65 Favored 'General case' 0 C--N 1.281 -2.391 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.745 176.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.44 ' HB2' HD22 ' A' ' 32' ' ' LEU . 19.2 tpt180 -134.09 129.3 35.79 Favored 'General case' 0 C--N 1.293 -1.876 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 -177.682 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -79.58 163.29 24.76 Favored 'General case' 0 C--N 1.28 -2.435 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.677 177.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.478 HG21 ' O ' ' A' ' 25' ' ' ARG . 57.4 t . . . . . 0 C--N 1.311 -1.09 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.797 175.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.545 ' HB3' ' HG2' ' A' ' 12' ' ' GLN . . . . . . . . 0 N--CA 1.438 -1.036 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.649 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 9.8 t70 -71.32 140.36 50.24 Favored 'General case' 0 N--CA 1.427 -1.582 0 N-CA-C 106.746 -1.575 . . . . 0.0 106.746 173.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 65.0 mt -54.29 -40.79 68.22 Favored 'General case' 0 C--N 1.305 -1.353 0 CA-C-O 121.232 0.539 . . . . 0.0 110.482 -179.112 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -65.12 -39.9 93.74 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 114.318 -1.31 . . . . 0.0 110.033 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.422 ' HB ' ' HB3' ' A' ' 8' ' ' ASP . 2.3 m -66.75 -49.53 65.67 Favored 'General case' 0 N--CA 1.401 -2.877 0 CA-C-N 114.829 -1.078 . . . . 0.0 109.578 179.663 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.649 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 23.9 mt-30 -56.35 -44.87 80.52 Favored 'General case' 0 CA--C 1.474 -1.957 0 CA-C-N 114.914 -1.039 . . . . 0.0 111.225 -179.052 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.967 ' HD3' HG21 ' A' ' 45' ' ' VAL 0.268 10.3 mmm180 -69.56 -30.77 68.65 Favored 'General case' 0 N--CA 1.405 -2.685 0 N-CA-C 115.092 1.516 . . . . 0.0 115.092 -177.193 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.8 t -78.92 -46.21 18.89 Favored 'General case' 0 C--N 1.261 -3.279 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 179.831 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.519 ' O ' ' HB ' ' A' ' 18' ' ' THR . 11.1 t0 -59.83 -48.15 82.86 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 124.016 0.926 . . . . 0.0 109.624 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.621 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 12.4 mm -72.5 -39.07 61.56 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.207 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.611 -177.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.52 ' O ' ' HG2' ' A' ' 21' ' ' LYS . . . -57.94 -35.11 70.66 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 177.657 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.59 ' HA ' ' HE2' ' A' ' 21' ' ' LYS . 1.8 m -64.94 -43.39 92.89 Favored 'General case' 0 N--CA 1.399 -2.986 0 CA-C-N 114.183 -1.372 . . . . 0.0 111.786 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.554 ' HB3' ' CG ' ' A' ' 93' ' ' PRO . 88.8 mt -75.31 -12.87 60.36 Favored 'General case' 0 C--N 1.268 -2.955 0 N-CA-C 113.207 0.817 . . . . 0.0 113.207 -175.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.621 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 17.5 mt -86.22 -29.17 23.37 Favored 'General case' 0 C--N 1.309 -1.185 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 176.283 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.59 ' HE2' ' HA ' ' A' ' 18' ' ' THR . 54.4 pttt -96.32 -18.75 19.75 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-N 115.516 -0.766 . . . . 0.0 111.511 -175.186 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.6 m -53.46 131.71 38.61 Favored 'General case' 0 N--CA 1.399 -3.005 0 CA-C-O 122.251 1.024 . . . . 0.0 111.254 170.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 59.5 m -65.67 141.24 58.44 Favored 'General case' 0 N--CA 1.406 -2.634 0 CA-C-N 113.355 -1.748 . . . . 0.0 112.527 -178.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.412 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP . 0.4 OUTLIER -112.13 159.88 18.09 Favored 'General case' 0 N--CA 1.41 -2.455 0 CA-C-N 114.948 -1.023 . . . . 0.0 112.738 179.864 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 28.3 mmt85 -130.86 144.69 51.64 Favored 'General case' 0 C--N 1.288 -2.082 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.365 -177.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 18.0 pttm -66.12 97.03 0.35 Allowed 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 122.213 1.006 . . . . 0.0 109.56 177.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 147.43 -17.44 1.49 Allowed Glycine 0 N--CA 1.427 -1.909 0 CA-C-N 113.636 -1.62 . . . . 0.0 109.965 -172.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -77.42 145.65 37.04 Favored 'General case' 0 CA--C 1.499 -0.986 0 CA-C-O 120.855 0.36 . . . . 0.0 110.113 177.324 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.402 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 58.8 m -104.44 132.71 50.38 Favored 'General case' 0 C--N 1.293 -1.877 0 N-CA-C 107.518 -1.289 . . . . 0.0 107.518 176.172 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.412 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 22.6 m95 -121.83 143.8 49.2 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 -178.9 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.44 ' HB2' ' HB2' ' A' ' 97' ' ' TRP . 57.6 m-85 -107.04 141.03 38.92 Favored 'General case' 0 C--N 1.28 -2.452 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.842 -174.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.51 ' HA ' ' O ' ' A' ' 90' ' ' ILE . 5.9 mp -93.21 135.64 34.22 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 122.048 0.927 . . . . 0.0 112.799 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.501 HG23 HD23 ' A' ' 92' ' ' LEU . 73.7 t -116.14 136.8 51.94 Favored 'Isoleucine or valine' 0 C--N 1.28 -2.45 0 N-CA-C 105.776 -1.935 . . . . 0.0 105.776 171.478 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.523 ' OD1' ' HG2' ' A' ' 36' ' ' ARG . 19.7 t0 -63.19 126.94 29.06 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 169.008 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.566 ' OG ' ' HE3' ' A' ' 39' ' ' LYS . 48.4 t -67.88 -23.86 65.17 Favored 'General case' 0 C--N 1.287 -2.15 0 CA-C-N 115.311 -0.858 . . . . 0.0 109.831 -171.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.523 ' HG2' ' OD1' ' A' ' 34' ' ' ASP . 17.3 mmt-85 -62.24 -40.68 96.98 Favored 'General case' 0 C--O 1.239 0.52 0 N-CA-C 109.603 -0.518 . . . . 0.0 109.603 -178.168 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.454 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 51.4 t90 -68.34 -45.52 72.65 Favored 'General case' 0 C--O 1.227 -0.094 0 CA-C-N 115.304 -0.862 . . . . 0.0 108.784 179.197 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.519 ' CG ' HD12 ' A' ' 90' ' ' ILE . 17.8 t80 -65.65 -34.56 78.51 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.984 -177.06 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.566 ' HE3' ' OG ' ' A' ' 35' ' ' SER . 96.7 mttt -68.51 -32.73 72.89 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-O 120.707 0.289 . . . . 0.0 111.438 176.395 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.454 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 20.1 tp60 -67.66 -41.61 83.5 Favored 'General case' 0 N--CA 1.412 -2.346 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 174.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.667 ' O ' HG22 ' A' ' 45' ' ' VAL . 52.8 t90 -65.67 -40.37 92.33 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 114.902 -1.044 . . . . 0.0 110.121 178.384 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.435 ' HD3' ' HA ' ' A' ' 39' ' ' LYS . 13.4 mtpp -52.06 -43.36 63.78 Favored 'General case' 0 C--O 1.216 -0.697 0 C-N-CA 124.408 1.083 . . . . 0.0 113.398 178.291 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 45.7 mttm -74.7 -40.89 61.07 Favored 'General case' 0 C--N 1.303 -1.422 0 C-N-CA 119.809 -0.756 . . . . 0.0 111.207 179.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.57 ' HB2' HG23 ' A' ' 60' ' ' VAL . 4.2 t80 -55.81 -33.92 64.88 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-N 114.389 -1.278 . . . . 0.0 111.933 179.752 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.967 HG21 ' HD3' ' A' ' 13' ' ' ARG . 3.4 m -94.41 -23.54 5.18 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.826 0 N-CA-C 112.608 0.595 . . . . 0.0 112.608 176.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.567 ' CA ' ' HG3' ' A' ' 52' ' ' LYS . . . 81.83 38.82 12.85 Favored Glycine 1 N--CA 1.391 -4.339 0 C-N-CA 120.033 -1.079 . . . . 0.0 110.498 -172.887 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.524 ' HB2' ' HE ' ' A' ' 13' ' ' ARG . 42.4 t80 -59.66 -49.4 77.89 Favored 'General case' 0 N--CA 1.433 -1.289 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 176.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -73.22 114.47 11.44 Favored 'General case' 0 N--CA 1.429 -1.519 0 CA-C-N 113.651 -1.613 . . . . 0.0 108.263 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 5.7 m -55.56 -27.44 49.09 Favored 'General case' 0 C--N 1.3 -1.571 0 C-N-CA 124.885 1.274 . . . . 0.0 113.206 -175.099 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 44.1 p90 -94.88 -0.91 53.61 Favored 'General case' 0 C--N 1.298 -1.661 0 O-C-N 122.153 -0.342 . . . . 0.0 111.097 -178.135 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -136.34 77.07 1.63 Allowed 'General case' 0 C--N 1.312 -1.028 0 C-N-CA 119.502 -0.879 . . . . 0.0 110.76 -173.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.567 ' HG3' ' CA ' ' A' ' 46' ' ' GLY . 0.0 OUTLIER -118.21 23.09 11.81 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-O 121.809 0.814 . . . . 0.0 111.523 177.029 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 74.4 m-85 -77.87 -22.59 49.56 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 176.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.463 ' HB3' HG11 ' A' ' 60' ' ' VAL . 11.1 mm100 -95.57 -0.68 51.71 Favored 'General case' 0 N--CA 1.419 -2.02 0 C-N-CA 124.733 1.213 . . . . 0.0 110.283 -179.02 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 53.4 ttp -66.18 115.72 6.48 Favored 'General case' 0 N--CA 1.419 -1.994 0 CA-C-O 121.34 0.59 . . . . 0.0 110.672 -176.184 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 79.15 12.73 83.7 Favored Glycine 0 N--CA 1.437 -1.285 0 CA-C-N 115.065 -0.971 . . . . 0.0 111.512 -179.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.615 ' HB3' HG22 ' A' ' 60' ' ' VAL . 5.4 t70 -87.06 146.4 26.1 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 -177.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.447 ' O ' ' HD2' ' A' ' 61' ' ' TYR . 4.6 pt20 -83.82 -21.51 32.07 Favored 'General case' 0 C--N 1.285 -2.211 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.827 -177.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -65.46 -22.86 66.8 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 121.654 0.74 . . . . 0.0 111.859 178.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.615 HG22 ' HB3' ' A' ' 57' ' ' ASP . 32.0 m -116.84 2.66 7.66 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.186 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.449 -173.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.447 ' HD2' ' O ' ' A' ' 58' ' ' GLN . 0.3 OUTLIER -68.78 118.32 59.68 Favored Pre-proline 0 C--N 1.313 -1.02 0 C-N-CA 120.115 -0.634 . . . . 0.0 109.969 -179.22 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -92.09 117.74 0.44 Allowed 'Trans proline' 0 N--CA 1.407 -3.563 0 C-N-CA 122.357 2.038 . . . . 0.0 110.455 176.103 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -74.54 -141.17 0.69 Allowed Glycine 0 C--N 1.268 -3.226 0 CA-C-N 114.158 -1.383 . . . . 0.0 111.949 175.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.523 ' HA ' ' O ' ' A' ' 104' ' ' TYR . 50.6 Cg_exo -53.69 131.56 44.65 Favored 'Trans proline' 0 C--O 1.251 1.133 0 C-N-CA 122.881 2.387 . . . . 0.0 113.041 -178.024 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 67.9 mt -60.99 122.76 12.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.381 -178.059 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -117.56 127.54 54.08 Favored 'General case' 0 C--N 1.297 -1.676 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.312 -179.574 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.477 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 93.5 m-20 -112.58 10.69 19.55 Favored 'General case' 0 C--N 1.301 -1.5 0 O-C-N 123.83 0.707 . . . . 0.0 111.104 -178.484 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 50.9 m -88.2 78.43 8.08 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 122.22 1.01 . . . . 0.0 111.621 -177.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 174.02 -37.77 0.12 Allowed Glycine 0 CA--C 1.48 -2.145 0 N-CA-C 104.91 -3.276 . . . . 0.0 104.91 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.486 HD11 ' HB3' ' A' ' 89' ' ' TYR . 28.8 tp -70.18 -45.6 66.37 Favored 'General case' 1 N--CA 1.374 -4.226 0 CA-C-N 112.221 -1.989 . . . . 0.0 107.769 168.866 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.541 ' O ' ' HE3' ' A' ' 80' ' ' LYS . 75.3 mt -71.05 159.75 34.16 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 114.643 -1.162 . . . . 0.0 109.64 175.254 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.401 ' HG2' ' HG2' ' A' ' 80' ' ' LYS . 41.8 mtpt . . . . . 0 C--N 1.323 -0.57 0 CA-C-O 120.776 0.322 . . . . 0.0 111.224 -178.328 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.435 ' HA ' HD13 ' A' ' 71' ' ' LEU . . . . . . . . 0 CA--C 1.512 -0.485 0 CA-C-O 121.768 0.794 . . . . 0.0 111.69 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 -130.02 2.78 4.81 Favored 'General case' 0 C--N 1.291 -1.937 0 N-CA-C 105.95 -1.87 . . . . 0.0 105.95 179.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.5 p -105.51 123.29 47.64 Favored 'General case' 0 C--N 1.293 -1.874 0 CA-C-N 114.107 -1.406 . . . . 0.0 113.074 -171.119 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.414 HD11 HG21 ' A' ' 113' ' ' ILE . 71.5 mt -93.72 138.54 31.82 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-O 120.736 0.303 . . . . 0.0 110.381 175.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.541 ' HE3' ' O ' ' A' ' 71' ' ' LEU . 99.1 mttt -72.35 139.87 48.15 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-O 121.32 0.581 . . . . 0.0 110.753 176.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -65.42 -18.17 65.1 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 122.011 0.91 . . . . 0.0 110.597 176.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 8.8 t-80 -82.82 -7.16 59.68 Favored 'General case' 0 C--N 1.296 -1.728 0 CA-C-N 114.169 -1.378 . . . . 0.0 110.676 -175.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.467 ' HG ' ' HB2' ' A' ' 80' ' ' LYS . 77.2 mt -76.35 130.48 38.14 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-O 121.148 0.499 . . . . 0.0 112.039 -175.613 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.675 HG21 HD12 ' A' ' 87' ' ' LEU . 50.9 mt -112.39 -179.37 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.29 -2.002 0 N-CA-C 105.645 -1.983 . . . . 0.0 105.645 173.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.651 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 13.0 t70 -63.83 -145.14 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.344 0 C-N-CA 124.737 1.215 . . . . 0.0 110.139 -179.342 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.593 ' HA ' ' O ' ' A' ' 89' ' ' TYR 0.254 0.0 OUTLIER -40.63 -17.69 0.01 OUTLIER 'General case' 0 N--CA 1.52 3.036 0 N-CA-C 117.006 2.225 . . . . 0.0 117.006 -175.147 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.675 HD12 HG21 ' A' ' 84' ' ' ILE . 43.4 mt -59.03 -52.48 65.56 Favored 'General case' 0 C--N 1.277 -2.579 0 C-N-CA 123.471 0.708 . . . . 0.0 109.782 170.526 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -112.59 -40.5 4.06 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.987 -176.439 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' TYR . . . . . 0.651 ' CE1' ' HA ' ' A' ' 85' ' ' ASP . 0.8 OUTLIER -135.74 178.43 7.05 Favored 'General case' 0 C--O 1.17 -3.097 0 C-N-CA 119.84 -0.744 . . . . 0.0 109.606 -179.983 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.519 HD12 ' CG ' ' A' ' 38' ' ' PHE . 6.8 mt -139.45 147.98 23.81 Favored 'Isoleucine or valine' 0 N--CA 1.404 -2.735 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 174.612 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.465 ' HA ' HD23 ' A' ' 91' ' ' LEU . 64.4 mt -109.72 129.54 55.6 Favored 'General case' 0 N--CA 1.399 -3.015 0 O-C-N 124.623 1.202 . . . . 0.0 111.008 178.026 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.501 HD23 HG23 ' A' ' 33' ' ' VAL . 1.5 mm? -123.43 150.03 59.74 Favored Pre-proline 0 C--N 1.27 -2.86 0 CA-C-N 113.419 -1.719 . . . . 0.0 106.47 -177.26 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.554 ' CG ' ' HB3' ' A' ' 19' ' ' LEU . 10.2 Cg_endo -64.95 168.34 13.94 Favored 'Trans proline' 0 N--CA 1.428 -2.332 0 N-CA-C 108.296 -1.463 . . . . 0.0 108.296 169.193 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 18.9 m -43.7 -48.12 7.88 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 123.667 0.604 . . . . 0.0 110.732 173.092 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -68.16 -36.39 79.55 Favored 'General case' 0 CA--C 1.485 -1.553 0 CA-C-N 115.509 -0.769 . . . . 0.0 112.401 -178.365 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -58.88 -57.89 17.45 Favored Glycine 0 N--CA 1.417 -2.632 0 N-CA-C 110.168 -1.173 . . . . 0.0 110.168 179.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.44 ' HB2' ' HB2' ' A' ' 31' ' ' TYR . 70.0 t-105 -54.63 -50.57 67.8 Favored 'General case' 0 N--CA 1.421 -1.893 0 C-N-CA 123.449 0.7 . . . . 0.0 110.611 174.822 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -50.59 -34.48 26.06 Favored 'General case' 0 C--O 1.215 -0.748 0 C-N-CA 123.029 0.532 . . . . 0.0 112.31 177.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 41.7 mttm -70.71 -50.02 40.79 Favored 'General case' 0 CA--C 1.456 -2.644 0 CA-C-O 120.862 0.363 . . . . 0.0 110.375 179.447 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.539 HD23 ' CE3' ' A' ' 103' ' ' TRP . 44.3 mt -65.64 -31.2 72.09 Favored 'General case' 0 C--N 1.264 -3.133 0 CA-C-N 115.078 -0.964 . . . . 0.0 111.804 -176.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.536 ' HA ' ' HA ' ' A' ' 105' ' ' THR . 12.7 t -81.06 -24.77 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.402 -2.847 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.319 174.752 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 37.6 t -76.35 -36.44 58.19 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 107.519 -1.289 . . . . 0.0 107.519 177.522 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' TRP . . . . . 0.539 ' CE3' HD23 ' A' ' 100' ' ' LEU . 50.0 m0 -80.9 -53.84 6.1 Favored 'General case' 0 N--CA 1.41 -2.445 0 CA-C-N 114.677 -1.147 . . . . 0.0 112.08 -177.16 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' TYR . . . . . 0.523 ' O ' ' HA ' ' A' ' 64' ' ' PRO . 41.6 m-85 -120.85 -3.38 9.7 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.521 -0.471 . . . . 0.0 112.187 -170.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.536 ' HA ' ' HA ' ' A' ' 101' ' ' VAL 0.265 7.2 t 50.02 -173.46 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.17 0 C-N-CA 126.591 1.956 . . . . 0.0 114.376 -174.132 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 44.9 tp -114.98 144.31 43.8 Favored 'General case' 0 C--N 1.256 -3.483 0 CA-C-N 113.578 -1.646 . . . . 0.0 109.458 -175.347 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . 0.506 ' SD ' ' HB2' ' A' ' 64' ' ' PRO . 65.2 mmm -65.33 156.64 31.47 Favored 'General case' 0 C--O 1.247 0.958 0 CA-C-O 121.584 0.707 . . . . 0.0 110.928 176.682 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -79.83 138.04 37.11 Favored 'General case' 0 C--N 1.278 -2.541 0 CA-C-N 114.77 -1.105 . . . . 0.0 111.951 -176.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 101.63 -37.21 3.75 Favored Glycine 0 N--CA 1.415 -2.762 0 CA-C-N 114.754 -1.112 . . . . 0.0 110.384 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 24.5 mp0 -74.97 158.15 33.76 Favored 'General case' 0 CA--C 1.499 -0.991 0 CA-C-O 121.679 0.752 . . . . 0.0 112.043 178.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -116.83 157.57 45.96 Favored Pre-proline 0 N--CA 1.408 -2.536 0 N-CA-C 105.364 -2.087 . . . . 0.0 105.364 175.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . 0.433 ' HB3' ' CE2' ' A' ' 97' ' ' TRP . 13.8 Cg_exo -73.63 122.32 7.74 Favored 'Trans proline' 0 CA--C 1.451 -3.651 0 N-CA-C 108.047 -1.559 . . . . 0.0 108.047 166.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.414 HG21 HD11 ' A' ' 79' ' ' LEU . 3.6 mp -83.01 106.96 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.38 -3.956 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 -179.42 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . 0.406 ' O ' ' HD3' ' A' ' 115' ' ' ARG . . . -103.5 129.46 50.68 Favored 'General case' 0 N--CA 1.402 -2.841 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.861 -179.141 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.406 ' HD3' ' O ' ' A' ' 114' ' ' ALA . 21.9 mmt180 -131.23 -172.51 2.86 Favored 'General case' 0 C--N 1.286 -2.154 0 N-CA-C 105.475 -2.046 . . . . 0.0 105.475 177.787 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -130.11 176.35 8.16 Favored 'General case' 0 C--N 1.269 -2.911 0 C-N-CA 118.575 -1.25 . . . . 0.0 111.46 -177.561 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 61.6 t . . . . . 0 C--N 1.31 -1.118 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 173.63 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.458 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . . . . . . 0 CA--C 1.499 -0.989 0 CA-C-O 121.458 0.647 . . . . 0.0 110.207 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.577 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 4.8 p-10 -84.46 153.54 23.29 Favored 'General case' 0 CA--C 1.455 -2.708 0 C-N-CA 118.988 -1.085 . . . . 0.0 109.324 173.598 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.484 ' O ' ' HG3' ' A' ' 13' ' ' ARG . 3.9 mm? -47.5 -46.16 27.01 Favored 'General case' 0 C--N 1.286 -2.19 0 C-N-CA 125.757 1.623 . . . . 0.0 112.1 -178.695 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -67.78 -36.66 80.85 Favored 'General case' 0 C--N 1.257 -3.419 0 CA-C-N 113.064 -1.88 . . . . 0.0 110.273 -177.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.458 ' CG2' ' HB1' ' A' ' 7' ' ' ALA . 1.7 m -67.82 -50.21 58.02 Favored 'General case' 0 N--CA 1.395 -3.189 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.393 176.676 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.577 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 87.8 mt-30 -50.92 -53.4 33.15 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 124.0 0.812 . . . . 0.0 111.387 -175.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.651 ' HG2' HG13 ' A' ' 45' ' ' VAL . 28.9 mtm180 -48.56 -60.04 3.02 Favored 'General case' 0 N--CA 1.487 1.416 0 CA-C-O 122.137 0.97 . . . . 0.0 110.676 176.777 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.9 m -65.26 -43.51 91.08 Favored 'General case' 0 N--CA 1.424 -1.727 0 CA-C-N 113.379 -1.737 . . . . 0.0 113.091 -171.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -68.22 -36.08 78.97 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.451 -176.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.511 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 22.9 mm -78.79 -37.77 20.65 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.158 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.248 177.253 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.2 -43.23 92.24 Favored 'General case' 0 CA--C 1.492 -1.279 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 179.689 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.41 ' O ' ' HB ' ' A' ' 22' ' ' THR . 2.3 m -55.43 -39.98 70.94 Favored 'General case' 0 N--CA 1.403 -2.775 0 C-N-CA 125.504 1.522 . . . . 0.0 111.543 178.189 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 78.5 mt -84.29 -13.89 51.25 Favored 'General case' 0 C--N 1.295 -1.799 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -174.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 59.7 mt -81.58 -17.54 47.97 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 175.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -104.01 -41.44 5.85 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.156 -1.384 . . . . 0.0 111.424 -175.035 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.41 ' HB ' ' O ' ' A' ' 18' ' ' THR . 1.4 t -46.31 167.29 0.02 OUTLIER 'General case' 0 C--O 1.242 0.702 0 C-N-CA 126.35 1.86 . . . . 0.0 114.81 -179.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 61.5 m -61.25 127.06 29.68 Favored 'General case' 0 N--CA 1.389 -3.502 0 CA-C-N 111.697 -2.501 . . . . 0.0 112.286 179.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.546 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP . 0.3 OUTLIER -111.7 -18.49 12.75 Favored 'General case' 0 C--N 1.283 -2.289 0 CA-C-N 113.797 -1.547 . . . . 0.0 113.116 -177.969 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.626 ' O ' HG11 ' A' ' 117' ' ' VAL . 9.9 mtm180 60.17 -152.67 0.39 Allowed 'General case' 0 C--N 1.253 -3.627 0 CA-C-N 112.838 -1.983 . . . . 0.0 109.09 -178.314 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 57.7 mtmt -126.43 29.02 5.85 Favored 'General case' 0 C--N 1.292 -1.91 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 172.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -153.3 33.33 0.78 Allowed Glycine 0 N--CA 1.435 -1.368 0 CA-C-N 114.33 -1.305 . . . . 0.0 113.074 -179.084 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.48 ' H ' HG23 ' A' ' 117' ' ' VAL . 7.9 t70 -109.56 173.45 6.32 Favored 'General case' 0 N--CA 1.484 1.264 0 N-CA-C 106.954 -1.498 . . . . 0.0 106.954 177.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.406 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 85.9 m -122.19 121.19 36.27 Favored 'General case' 0 C--N 1.282 -2.331 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.546 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 17.4 m95 -103.31 126.74 50.63 Favored 'General case' 0 N--CA 1.388 -3.564 0 CA-C-N 114.662 -1.153 . . . . 0.0 109.388 -179.249 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.446 ' HB2' ' HB2' ' A' ' 97' ' ' TRP . 82.8 m-85 -98.38 144.47 27.72 Favored 'General case' 0 C--N 1.272 -2.782 0 CA-C-N 115.065 -0.971 . . . . 0.0 110.975 -175.567 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.55 ' CD1' HD21 ' A' ' 91' ' ' LEU . 6.1 mp -93.5 141.9 27.95 Favored 'General case' 0 N--CA 1.426 -1.665 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.971 -177.254 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.547 ' CG1' ' HB ' ' A' ' 90' ' ' ILE . 0.6 OUTLIER -133.11 142.24 42.62 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.756 0 CA-C-N 114.377 -1.283 . . . . 0.0 108.365 174.963 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.482 ' OD1' ' HB2' ' A' ' 36' ' ' ARG . 10.5 t70 -61.13 128.98 39.08 Favored 'General case' 0 C--N 1.305 -1.349 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 176.205 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.507 ' O ' ' HD3' ' A' ' 39' ' ' LYS . 19.5 p -61.58 -34.86 76.33 Favored 'General case' 0 C--O 1.209 -1.028 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 -173.721 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.482 ' HB2' ' OD1' ' A' ' 34' ' ' ASP . 0.0 OUTLIER -64.13 -36.7 84.88 Favored 'General case' 0 CA--C 1.482 -1.667 0 CA-C-O 121.23 0.538 . . . . 0.0 111.204 -176.564 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.509 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 51.1 t90 -63.32 -44.04 96.08 Favored 'General case' 0 C--N 1.287 -2.131 0 CA-C-N 113.992 -1.458 . . . . 0.0 108.266 178.164 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -69.64 -43.17 73.17 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.829 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.507 ' HD3' ' O ' ' A' ' 35' ' ' SER . 14.6 mptt -55.38 -32.74 62.86 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 122.601 0.361 . . . . 0.0 111.937 171.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.509 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 62.6 tp60 -72.32 -46.62 54.82 Favored 'General case' 0 N--CA 1.419 -2.016 0 C-N-CA 123.22 0.608 . . . . 0.0 109.464 176.727 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 72.6 t90 -58.4 -39.22 79.11 Favored 'General case' 0 C--O 1.213 -0.821 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.871 177.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.517 ' HG2' ' CD1' ' A' ' 47' ' ' PHE . 15.3 mtpp -56.39 -40.0 73.89 Favored 'General case' 0 N--CA 1.44 -0.942 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.428 ' HB3' ' HG3' ' A' ' 54' ' ' GLN . 39.6 mttp -72.31 -44.67 62.37 Favored 'General case' 0 C--N 1.293 -1.87 0 CA-C-O 121.133 0.492 . . . . 0.0 110.25 177.478 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.688 ' HB2' HG23 ' A' ' 60' ' ' VAL . 1.0 OUTLIER -58.12 -39.1 77.83 Favored 'General case' 0 N--CA 1.418 -2.072 0 CA-C-N 114.524 -1.217 . . . . 0.0 110.948 -179.226 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.651 HG13 ' HG2' ' A' ' 13' ' ' ARG . 2.6 p -92.25 -23.62 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.387 -3.615 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -175.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.562 ' HA2' ' HG3' ' A' ' 52' ' ' LYS . . . 93.07 22.85 26.54 Favored Glycine 0 N--CA 1.433 -1.535 0 C-N-CA 120.077 -1.059 . . . . 0.0 111.14 -175.249 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.545 ' HB2' ' CG1' ' A' ' 45' ' ' VAL . 20.1 t80 -78.87 -30.81 45.23 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 177.298 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -76.57 111.75 12.39 Favored 'General case' 0 CA--C 1.483 -1.598 0 N-CA-C 106.096 -1.816 . . . . 0.0 106.096 173.254 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 2.5 p -65.27 -19.72 66.09 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 113.065 0.765 . . . . 0.0 113.065 -175.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 42.1 p90 -97.69 -0.47 45.46 Favored 'General case' 0 C--N 1.286 -2.195 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.446 178.463 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.432 ' OD1' ' HG2' ' A' ' 54' ' ' GLN . 20.4 t0 -141.63 91.9 2.41 Favored 'General case' 0 CA--C 1.491 -1.318 0 C-N-CA 118.738 -1.185 . . . . 0.0 111.208 -176.593 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.562 ' HG3' ' HA2' ' A' ' 46' ' ' GLY . 0.1 OUTLIER -121.77 18.86 11.07 Favored 'General case' 0 C--N 1.291 -1.939 0 CA-C-O 121.639 0.733 . . . . 0.0 110.541 175.836 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -78.91 -33.36 45.59 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 176.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.484 ' HB3' HG11 ' A' ' 60' ' ' VAL . 10.3 mm100 -81.76 -3.85 54.86 Favored 'General case' 0 N--CA 1.42 -1.973 0 CA-C-N 113.854 -1.521 . . . . 0.0 110.863 -177.139 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . 0.57 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 46.6 ttm -62.63 114.83 3.8 Favored 'General case' 0 N--CA 1.421 -1.918 0 C-N-CA 123.115 0.566 . . . . 0.0 111.149 -177.785 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.01 5.66 89.47 Favored Glycine 0 N--CA 1.434 -1.481 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.994 179.301 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -81.38 141.18 34.22 Favored 'General case' 0 CA--C 1.496 -1.122 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 -177.386 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.554 ' O ' ' HD2' ' A' ' 61' ' ' TYR . 11.9 pt20 -78.72 -20.34 50.28 Favored 'General case' 0 C--N 1.277 -2.567 0 CA-C-N 114.926 -1.033 . . . . 0.0 109.332 177.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -58.18 -29.97 66.06 Favored 'General case' 0 CA--C 1.497 -1.082 0 CA-C-O 121.939 0.876 . . . . 0.0 111.064 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.688 HG23 ' HB2' ' A' ' 44' ' ' TYR . 21.7 m -115.29 2.3 8.04 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.998 0 CA-C-N 114.744 -1.116 . . . . 0.0 112.253 -171.297 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.554 ' HD2' ' O ' ' A' ' 58' ' ' GLN . 1.8 p90 -54.51 116.68 11.36 Favored Pre-proline 0 C--N 1.306 -1.307 0 O-C-N 124.373 1.045 . . . . 0.0 111.594 -175.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 61' ' ' TYR . 9.0 Cg_endo -87.92 109.17 0.63 Allowed 'Trans proline' 0 N--CA 1.426 -2.469 0 C-N-CA 122.763 2.309 . . . . 0.0 109.833 176.456 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -74.28 -141.19 0.65 Allowed Glycine 0 C--N 1.283 -2.38 0 CA-C-N 114.662 -1.154 . . . . 0.0 113.023 177.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.64 129.16 33.57 Favored 'Trans proline' 0 C--O 1.24 0.584 0 C-N-CA 123.04 2.493 . . . . 0.0 113.346 -176.592 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.584 HD11 ' HB3' ' A' ' 100' ' ' LEU . 47.6 mt -65.55 114.17 2.71 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.067 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.469 -178.719 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -108.36 127.53 53.96 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-O 120.775 0.321 . . . . 0.0 110.502 178.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.534 HD21 ' HA ' ' A' ' 33' ' ' VAL . 15.2 m120 -113.09 6.37 17.56 Favored 'General case' 0 C--N 1.302 -1.487 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.396 -176.693 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 12.1 t -53.8 -32.99 54.63 Favored 'General case' 0 CA--C 1.557 1.233 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 -174.355 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -73.96 -14.79 79.99 Favored Glycine 0 CA--C 1.525 0.691 0 C-N-CA 121.202 -0.523 . . . . 0.0 112.703 -179.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.516 HD12 HD22 ' A' ' 67' ' ' ASN . 61.6 mt -89.67 -15.56 32.37 Favored 'General case' 0 C--O 1.243 0.755 0 CA-C-O 121.949 0.881 . . . . 0.0 109.273 -179.451 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.633 ' HA ' ' HA ' ' A' ' 79' ' ' LEU . 74.9 mt -86.45 161.44 18.63 Favored 'General case' 0 C--N 1.292 -1.929 0 CA-C-N 114.863 -1.062 . . . . 0.0 112.065 -173.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt . . . . . 0 C--N 1.308 -1.199 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 178.443 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.491 ' HA ' HD13 ' A' ' 71' ' ' LEU . . . . . . . . 0 C--O 1.22 -0.489 0 CA-C-O 122.135 0.969 . . . . 0.0 110.969 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 -114.82 -1.95 13.07 Favored 'General case' 0 C--N 1.286 -2.18 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 178.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.8 m -93.87 107.01 18.95 Favored 'General case' 0 C--N 1.296 -1.76 0 CA-C-N 114.247 -1.342 . . . . 0.0 108.541 -177.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.633 ' HA ' ' HA ' ' A' ' 71' ' ' LEU . 1.5 pp -107.91 154.76 21.13 Favored 'General case' 0 C--N 1.292 -1.925 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.433 -174.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.473 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 50.3 mtmt -66.27 112.38 3.95 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 122.052 0.929 . . . . 0.0 111.007 179.194 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -60.12 -27.85 67.38 Favored 'General case' 0 C--N 1.298 -1.656 0 C-N-CA 124.979 1.312 . . . . 0.0 112.781 -173.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 33.0 m170 -91.96 11.58 24.62 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 112.43 0.53 . . . . 0.0 112.43 -175.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 80' ' ' LYS . 61.5 mt -77.36 133.95 38.59 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-O 121.007 0.432 . . . . 0.0 111.266 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 42.8 mt -81.0 164.15 3.11 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.179 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 177.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.742 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 5.3 p-10 -64.39 -110.87 0.0 OUTLIER 'General case' 0 C--O 1.19 -2.079 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -176.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -44.11 -29.67 0.65 Allowed 'General case' 0 CA--C 1.557 1.232 0 C-N-CA 127.946 2.498 . . . . 0.0 113.466 -177.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 22.9 mt -72.57 -57.59 4.03 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.283 -178.721 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -86.55 -29.45 22.65 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.637 -176.044 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' TYR . . . . . 0.742 ' CE1' ' HA ' ' A' ' 85' ' ' ASP . 7.8 p90 -155.94 -163.06 1.41 Allowed 'General case' 0 C--O 1.194 -1.853 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 -175.386 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.547 ' HB ' ' CG1' ' A' ' 33' ' ' VAL . 0.6 OUTLIER -136.74 148.48 26.79 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.085 0 N-CA-C 106.673 -1.603 . . . . 0.0 106.673 167.138 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.55 HD21 ' CD1' ' A' ' 32' ' ' LEU . 15.9 mt -107.33 123.49 48.42 Favored 'General case' 1 N--CA 1.367 -4.612 0 O-C-N 124.55 1.156 . . . . 0.0 109.24 169.688 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.464 HD13 HD23 ' A' ' 100' ' ' LEU . 12.0 mt -118.12 146.87 40.25 Favored Pre-proline 0 C--N 1.283 -2.318 0 N-CA-C 106.315 -1.735 . . . . 0.0 106.315 -178.098 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -71.17 169.56 20.34 Favored 'Trans proline' 0 C--O 1.259 1.574 0 C-N-CA 121.974 1.783 . . . . 0.0 108.109 176.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.593 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 98.6 m -38.96 -52.2 1.79 Allowed 'General case' 0 CA--C 1.543 0.675 0 O-C-N 123.991 0.807 . . . . 0.0 111.707 178.082 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -72.66 -30.95 64.71 Favored 'General case' 0 CA--C 1.498 -1.021 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 -175.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.614 ' O ' HD22 ' A' ' 100' ' ' LEU . . . -62.75 -55.05 29.21 Favored Glycine 0 N--CA 1.43 -1.722 0 N-CA-C 109.158 -1.577 . . . . 0.0 109.158 178.102 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.446 ' HB2' ' HB2' ' A' ' 31' ' ' TYR . 68.5 t-105 -58.79 -49.82 76.25 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 123.752 0.821 . . . . 0.0 110.047 178.777 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.593 ' HB2' ' O ' ' A' ' 94' ' ' THR . 5.9 t-20 -48.52 -44.33 36.05 Favored 'General case' 0 C--O 1.207 -1.174 0 C-N-CA 124.909 1.283 . . . . 0.0 110.11 179.096 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -66.84 -51.82 51.03 Favored 'General case' 0 N--CA 1.423 -1.797 0 CA-C-O 119.16 -0.447 . . . . 0.0 111.458 178.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.614 HD22 ' O ' ' A' ' 96' ' ' GLY . 0.4 OUTLIER -59.47 -34.51 72.64 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 121.396 0.617 . . . . 0.0 112.071 179.929 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.507 ' HA ' ' HA ' ' A' ' 105' ' ' THR . 24.0 t -78.0 -27.34 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.378 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.969 178.183 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 73.8 m -78.87 -32.08 45.79 Favored 'General case' 0 C--N 1.291 -1.969 0 O-C-N 121.08 -1.013 . . . . 0.0 109.022 176.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' TRP . . . . . . . . . . . . . 50.6 m0 -79.88 -49.78 11.43 Favored 'General case' 0 N--CA 1.423 -1.792 0 CA-C-N 115.428 -0.805 . . . . 0.0 112.316 -177.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -129.92 5.06 4.96 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -175.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.507 ' HA ' ' HA ' ' A' ' 101' ' ' VAL 0.321 13.6 t 49.63 -176.5 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 123.876 1.798 . . . . 0.0 115.268 -176.926 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.426 HD13 ' CH2' ' A' ' 97' ' ' TRP . 37.0 tp -104.56 156.33 18.05 Favored 'General case' 1 C--N 1.23 -4.623 0 CA-C-N 112.022 -2.354 . . . . 0.0 107.251 -175.982 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 32.6 tpp -69.38 132.58 46.6 Favored 'General case' 1 N--CA 1.366 -4.633 0 CA-C-O 122.353 1.073 . . . . 0.0 110.294 178.559 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -63.92 136.87 57.72 Favored 'General case' 0 C--N 1.251 -3.677 0 CA-C-N 112.29 -2.232 . . . . 0.0 111.15 -176.093 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 93.64 -18.04 57.31 Favored Glycine 0 N--CA 1.416 -2.684 0 CA-C-N 114.99 -1.005 . . . . 0.0 112.533 179.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -113.88 127.33 55.94 Favored 'General case' 1 N--CA 1.362 -4.866 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 -179.581 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 -98.36 153.32 38.08 Favored Pre-proline 0 C--N 1.301 -1.536 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 -179.518 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_exo -48.49 129.36 19.66 Favored 'Trans proline' 0 CA--C 1.485 -1.953 0 C-N-CA 124.397 3.398 . . . . 0.0 115.985 -174.395 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.44 ' N ' HD12 ' A' ' 113' ' ' ILE . 3.1 mp -92.4 108.95 20.83 Favored 'Isoleucine or valine' 0 N--CA 1.384 -3.732 0 CA-C-N 111.796 -2.456 . . . . 0.0 105.764 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . 0.406 ' HB1' ' CG2' ' A' ' 29' ' ' THR . . . -118.6 149.89 40.6 Favored 'General case' 0 C--N 1.292 -1.901 0 N-CA-C 114.02 1.119 . . . . 0.0 114.02 -173.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 81.8 mtt180 -135.61 167.1 21.74 Favored 'General case' 0 CA--C 1.47 -2.113 0 C-N-CA 125.873 1.669 . . . . 0.0 107.121 172.181 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -101.33 176.02 5.38 Favored 'General case' 0 C--N 1.262 -3.234 0 C-N-CA 118.536 -1.266 . . . . 0.0 110.902 179.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.626 HG11 ' O ' ' A' ' 25' ' ' ARG . 48.3 t . . . . . 0 C--O 1.241 0.625 0 CA-C-O 122.687 1.232 . . . . 0.0 112.495 -176.166 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.488 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . . . . . . 0 CA--C 1.496 -1.112 0 CA-C-O 121.371 0.605 . . . . 0.0 111.34 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.652 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 13.3 t70 -64.19 143.06 58.17 Favored 'General case' 0 CA--C 1.48 -1.724 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.072 171.353 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -40.3 -56.83 1.88 Allowed 'General case' 0 C--N 1.299 -1.595 0 C-N-CA 126.422 1.889 . . . . 0.0 112.407 176.569 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -73.66 -25.66 60.37 Favored 'General case' 0 C--N 1.27 -2.879 0 CA-C-N 114.682 -1.144 . . . . 0.0 110.771 -174.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.526 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 2.2 m -68.31 -44.98 74.19 Favored 'General case' 0 N--CA 1.398 -3.064 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 175.553 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.652 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 75.1 mt-30 -55.41 -61.62 2.22 Favored 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 123.761 0.825 . . . . 0.0 112.484 -175.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.477 ' HB3' HG13 ' A' ' 45' ' ' VAL . 1.4 ptm180 -51.23 -41.56 60.4 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 121.373 0.606 . . . . 0.0 112.32 179.125 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.6 m -72.53 -44.25 62.43 Favored 'General case' 0 C--N 1.291 -1.954 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.792 -176.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -76.04 -19.6 58.49 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.144 -174.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.607 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 27.4 mm -87.71 -31.07 5.71 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.159 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.024 176.242 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.466 ' O ' ' HG3' ' A' ' 21' ' ' LYS . . . -59.36 -35.09 73.24 Favored 'General case' 0 CA--C 1.498 -1.029 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 -177.828 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 7.3 m -53.8 -53.32 54.04 Favored 'General case' 0 N--CA 1.415 -2.181 0 C-N-CA 126.506 1.922 . . . . 0.0 111.048 176.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.657 ' HB3' ' HD2' ' A' ' 93' ' ' PRO . 1.6 mm? -72.1 -15.23 62.0 Favored 'General case' 1 N--CA 1.356 -5.141 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 179.951 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.607 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 11.9 mt -86.03 -24.1 26.53 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-O 121.929 0.871 . . . . 0.0 109.617 177.824 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.466 ' HG3' ' O ' ' A' ' 17' ' ' ALA . 0.1 OUTLIER -90.9 -4.12 56.79 Favored 'General case' 0 CA--C 1.5 -0.98 0 CA-C-O 122.33 1.062 . . . . 0.0 111.521 -174.25 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 32.0 m -90.07 141.44 28.67 Favored 'General case' 0 N--CA 1.389 -3.49 0 CA-C-N 113.557 -1.656 . . . . 0.0 111.048 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.1 m -108.62 166.26 10.93 Favored 'General case' 0 N--CA 1.399 -2.977 0 CA-C-N 113.734 -1.575 . . . . 0.0 110.743 178.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.512 HD13 ' H ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -108.06 167.03 10.28 Favored 'General case' 1 N--CA 1.36 -4.936 0 CA-C-N 113.121 -1.854 . . . . 0.0 114.111 -170.897 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.645 ' O ' HG21 ' A' ' 117' ' ' VAL . 0.0 OUTLIER -126.83 159.86 32.63 Favored 'General case' 0 C--N 1.261 -3.251 0 CA-C-N 111.423 -2.626 . . . . 0.0 104.873 -178.821 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -67.6 132.6 47.85 Favored 'General case' 0 C--N 1.289 -2.063 0 CA-C-N 117.939 0.336 . . . . 0.0 110.983 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 99.01 -2.7 58.21 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.864 -0.684 . . . . 0.0 113.559 176.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.564 ' OD2' ' HB2' ' A' ' 25' ' ' ARG . 8.3 m-20 -86.77 155.51 20.3 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 117.18 0.49 . . . . 0.0 112.179 -177.672 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.428 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 41.3 m -108.67 136.56 48.04 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.3 -178.692 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.475 ' CZ2' HD12 ' A' ' 24' ' ' LEU . 36.4 m95 -122.46 153.89 38.53 Favored 'General case' 0 N--CA 1.429 -1.515 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 176.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -106.56 129.35 54.52 Favored 'General case' 0 C--N 1.273 -2.729 0 CA-C-O 120.992 0.425 . . . . 0.0 110.246 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.665 HD11 ' CG ' ' A' ' 89' ' ' TYR . 27.1 tp -90.0 128.98 36.38 Favored 'General case' 1 N--CA 1.367 -4.625 0 CA-C-N 114.335 -1.302 . . . . 0.0 113.039 -177.229 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.403 HG12 ' O ' ' A' ' 34' ' ' ASP . 55.3 t -118.09 139.77 44.02 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.012 0 C-N-CA 126.111 1.765 . . . . 0.0 108.743 -178.646 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.587 ' OD2' ' HB2' ' A' ' 36' ' ' ARG . 10.9 t70 -64.73 123.53 19.58 Favored 'General case' 0 C--N 1.299 -1.615 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 169.812 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.4 t -65.6 -27.55 68.49 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 120.989 0.423 . . . . 0.0 109.883 -172.564 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.587 ' HB2' ' OD2' ' A' ' 34' ' ' ASP . 67.8 mtt85 -66.95 -34.95 78.9 Favored 'General case' 0 C--O 1.243 0.752 0 C-N-CA 123.459 0.704 . . . . 0.0 110.236 -177.608 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 69.7 t90 -71.34 -46.25 60.99 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 175.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 30.3 t80 -58.6 -41.44 85.83 Favored 'General case' 0 CA--C 1.549 0.937 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.979 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.575 ' O ' ' HG3' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -51.32 -48.87 62.23 Favored 'General case' 0 CA--C 1.489 -1.395 0 CA-C-N 118.231 0.468 . . . . 0.0 111.178 173.075 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.406 ' HG3' ' O ' ' A' ' 60' ' ' VAL . 22.4 tp60 -60.12 -43.92 95.29 Favored 'General case' 0 N--CA 1.409 -2.498 0 O-C-N 123.796 0.685 . . . . 0.0 110.634 -177.101 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 76.5 t90 -61.07 -39.99 91.97 Favored 'General case' 0 C--O 1.214 -0.77 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.451 178.526 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.508 ' HD3' ' HA ' ' A' ' 39' ' ' LYS . 14.4 mtpp -60.1 -41.0 91.57 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-O 120.927 0.394 . . . . 0.0 111.742 -178.494 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.575 ' HG3' ' O ' ' A' ' 39' ' ' LYS . 18.3 mtpp -73.57 -39.06 64.94 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 -175.316 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.688 ' HB2' HG23 ' A' ' 60' ' ' VAL . 0.2 OUTLIER -67.41 -44.34 79.03 Favored 'General case' 0 N--CA 1.428 -1.543 0 CA-C-N 114.173 -1.376 . . . . 0.0 111.205 -179.654 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.477 HG13 ' HB3' ' A' ' 13' ' ' ARG . 2.3 p -85.14 -12.34 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.608 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.323 -174.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 66.33 43.15 93.39 Favored Glycine 0 N--CA 1.44 -1.086 0 N-CA-C 109.879 -1.288 . . . . 0.0 109.879 -175.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.466 ' HB2' ' CG1' ' A' ' 45' ' ' VAL . 88.2 t80 -64.82 -40.51 95.32 Favored 'General case' 0 N--CA 1.437 -1.111 0 C-N-CA 123.802 0.841 . . . . 0.0 108.976 -179.039 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.462 ' O ' ' HB2' ' A' ' 52' ' ' LYS . 7.4 m-20 -95.64 132.74 40.48 Favored 'General case' 0 C--N 1.298 -1.639 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 179.253 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.2 m -69.11 -22.44 63.97 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-O 121.488 0.661 . . . . 0.0 111.982 -179.465 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 38.7 p90 -99.3 2.3 45.34 Favored 'General case' 0 C--N 1.302 -1.489 0 C-N-CA 123.512 0.725 . . . . 0.0 110.379 -177.651 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.499 ' OD2' ' HG2' ' A' ' 43' ' ' LYS . 14.9 t70 -150.18 73.15 1.14 Allowed 'General case' 0 CA--C 1.472 -2.03 0 N-CA-C 103.608 -2.738 . . . . 0.0 103.608 -176.634 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 48' ' ' ASP 0.386 53.4 tptt -142.57 13.89 1.95 Allowed 'General case' 0 N--CA 1.393 -3.3 0 CA-C-N 110.661 -2.972 . . . . 0.0 109.237 -157.733 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 59.7 m-85 -99.36 -13.28 19.67 Favored 'General case' 0 C--N 1.293 -1.88 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.435 -173.332 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.545 ' HB3' HG11 ' A' ' 60' ' ' VAL . 43.0 mt-30 -97.94 6.98 47.08 Favored 'General case' 0 N--CA 1.426 -1.644 0 N-CA-C 107.961 -1.125 . . . . 0.0 107.961 176.605 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . 0.526 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 56.7 ttp -63.63 116.02 5.27 Favored 'General case' 0 N--CA 1.412 -2.352 0 CA-C-N 114.795 -1.093 . . . . 0.0 109.848 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.73 18.26 75.73 Favored Glycine 0 N--CA 1.429 -1.796 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.612 -179.192 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.59 ' HB3' HG22 ' A' ' 60' ' ' VAL . 9.3 t0 -94.34 143.95 25.96 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 179.313 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.451 ' O ' ' HD2' ' A' ' 61' ' ' TYR . 13.7 pt20 -84.3 -15.79 45.37 Favored 'General case' 0 C--N 1.291 -1.95 0 CA-C-O 122.007 0.908 . . . . 0.0 110.647 -179.198 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 -64.71 -28.06 69.34 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-N 114.659 -1.155 . . . . 0.0 111.217 177.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.688 HG23 ' HB2' ' A' ' 44' ' ' TYR . 33.2 m -115.65 1.82 8.12 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.099 0 CA-C-N 114.952 -1.022 . . . . 0.0 112.089 -172.038 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.451 ' HD2' ' O ' ' A' ' 58' ' ' GLN . 0.8 OUTLIER -64.87 118.13 45.68 Favored Pre-proline 0 C--N 1.307 -1.266 0 C-N-CA 119.638 -0.825 . . . . 0.0 109.696 -178.988 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 61' ' ' TYR . 18.4 Cg_endo -87.46 113.8 0.95 Allowed 'Trans proline' 0 N--CA 1.412 -3.282 0 C-N-CA 122.429 2.086 . . . . 0.0 109.828 177.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -73.26 -134.35 0.23 Allowed Glycine 0 C--N 1.275 -2.816 0 CA-C-N 114.233 -1.348 . . . . 0.0 112.105 177.115 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -56.65 131.06 43.31 Favored 'Trans proline' 0 CA--C 1.502 -1.108 0 C-N-CA 122.518 2.146 . . . . 0.0 112.357 -177.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.528 ' O ' HD23 ' A' ' 106' ' ' LEU . 96.2 mt -58.56 112.44 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.551 0 CA-C-N 114.365 -1.288 . . . . 0.0 109.505 177.185 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -106.86 103.45 12.89 Favored 'General case' 0 C--N 1.288 -2.095 0 N-CA-C 107.073 -1.455 . . . . 0.0 107.073 178.11 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.535 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 90.3 m-20 -90.74 6.22 45.0 Favored 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.818 173.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.8 m -54.13 -29.95 47.06 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.583 1.153 . . . . 0.0 111.971 -177.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -64.94 -25.16 70.58 Favored Glycine 0 CA--C 1.523 0.589 0 C-N-CA 121.59 -0.338 . . . . 0.0 112.295 178.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 72.8 mt -92.22 -23.03 19.48 Favored 'General case' 0 CA--C 1.496 -1.097 0 CA-C-O 120.816 0.341 . . . . 0.0 110.198 179.099 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 67' ' ' ASN . 21.5 mt -78.94 152.18 31.24 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.788 -172.418 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 72.9 mttt . . . . . 0 N--CA 1.422 -1.875 0 CA-C-O 122.981 1.372 . . . . 0.0 114.589 177.013 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.512 -0.486 0 CA-C-O 121.813 0.816 . . . . 0.0 110.1 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 15.2 mm-40 -119.69 7.24 11.02 Favored 'General case' 0 C--N 1.28 -2.431 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 -178.258 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 50.0 m -132.7 134.27 44.57 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 114.197 -1.365 . . . . 0.0 111.917 -173.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.9 mt -78.64 157.74 28.59 Favored 'General case' 0 C--N 1.315 -0.93 0 O-C-N 123.499 0.499 . . . . 0.0 109.731 175.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -72.89 158.47 35.44 Favored 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 173.054 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -90.06 -3.92 57.67 Favored 'General case' 0 C--N 1.293 -1.862 0 CA-C-O 121.075 0.464 . . . . 0.0 111.249 -178.47 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -99.25 11.37 39.25 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -177.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 32.6 mt -84.24 166.82 17.2 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-O 121.854 0.835 . . . . 0.0 113.162 -170.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.627 HG21 HD12 ' A' ' 87' ' ' LEU . 53.8 mt -142.23 173.61 7.21 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 N-CA-C 105.14 -2.17 . . . . 0.0 105.14 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.643 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 25.8 t70 -67.95 -142.03 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.95 0 CA-C-O 117.37 -1.3 . . . . 0.0 110.438 -179.524 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.509 ' HA ' ' O ' ' A' ' 89' ' ' TYR . 9.5 pt-20 -40.53 -18.62 0.01 OUTLIER 'General case' 0 N--CA 1.509 2.503 0 N-CA-C 117.625 2.454 . . . . 0.0 117.625 -173.09 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.627 HD12 HG21 ' A' ' 84' ' ' ILE . 21.0 mt -62.24 -51.57 67.23 Favored 'General case' 0 C--N 1.285 -2.232 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 171.049 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -102.12 -45.82 5.03 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.903 -177.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' TYR . . . . . 0.665 ' CG ' HD11 ' A' ' 32' ' ' LEU . 0.9 OUTLIER -140.3 167.89 21.08 Favored 'General case' 0 C--O 1.164 -3.416 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.669 -174.096 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.495 ' O ' HD12 ' A' ' 32' ' ' LEU . 4.3 mt -136.16 146.69 28.77 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.511 0 O-C-N 120.851 -1.156 . . . . 0.0 110.665 178.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.461 HD23 ' HA ' ' A' ' 91' ' ' LEU . 64.5 mt -109.04 133.72 52.61 Favored 'General case' 0 C--N 1.291 -1.958 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.761 178.651 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.46 HD12 ' N ' ' A' ' 92' ' ' LEU . 1.0 OUTLIER -140.78 156.13 68.97 Favored Pre-proline 0 C--N 1.289 -2.038 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 -178.54 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.657 ' HD2' ' HB3' ' A' ' 19' ' ' LEU . 39.6 Cg_exo -64.58 168.9 12.19 Favored 'Trans proline' 0 C--O 1.252 1.215 0 C-N-CA 122.975 2.45 . . . . 0.0 111.225 175.789 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.469 HG22 ' ND2' ' A' ' 98' ' ' ASN . 86.9 m -45.62 -47.76 14.73 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 124.421 1.088 . . . . 0.0 109.766 172.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.538 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.1 mp0 -51.8 -54.41 29.07 Favored 'General case' 0 C--O 1.209 -1.027 0 C-N-CA 125.421 1.488 . . . . 0.0 110.689 178.386 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.561 ' O ' HD22 ' A' ' 100' ' ' LEU . . . -54.98 -60.97 7.89 Favored Glycine 0 N--CA 1.43 -1.748 0 O-C-N 124.388 1.055 . . . . 0.0 111.273 -177.533 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.46 ' HZ2' HD11 ' A' ' 106' ' ' LEU . 68.5 t-105 -52.13 -50.22 62.13 Favored 'General case' 0 C--N 1.308 -1.238 0 C-N-CA 124.361 1.064 . . . . 0.0 111.184 178.385 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.469 ' ND2' HG22 ' A' ' 94' ' ' THR . 89.6 m-20 -53.47 -37.21 62.45 Favored 'General case' 0 C--O 1.187 -2.208 0 CA-C-O 118.791 -0.623 . . . . 0.0 111.585 177.74 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.464 ' HG3' ' O ' ' A' ' 95' ' ' GLU . 87.6 mttt -69.56 -50.36 45.57 Favored 'General case' 0 N--CA 1.41 -2.449 0 CA-C-N 118.6 0.636 . . . . 0.0 109.827 -178.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.561 HD22 ' O ' ' A' ' 96' ' ' GLY . 0.8 OUTLIER -58.75 -38.49 78.55 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.295 0.569 . . . . 0.0 111.731 178.588 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.414 ' O ' ' HA ' ' A' ' 105' ' ' THR . 37.9 t -74.35 -31.16 27.8 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.931 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.428 178.816 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 57.9 m -72.17 -36.16 69.2 Favored 'General case' 0 N--CA 1.418 -2.071 0 CA-C-O 121.717 0.77 . . . . 0.0 109.512 -179.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' TRP . . . . . 0.407 ' CZ2' ' HB3' ' A' ' 99' ' ' LYS . 38.4 m0 -78.57 -51.33 10.08 Favored 'General case' 0 N--CA 1.424 -1.738 0 CA-C-N 114.692 -1.14 . . . . 0.0 111.998 -176.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -123.2 4.39 9.21 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 114.558 1.318 . . . . 0.0 114.558 -172.427 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.414 ' HA ' ' O ' ' A' ' 101' ' ' VAL 0.271 22.8 p 54.29 174.87 0.02 OUTLIER 'General case' 0 N--CA 1.413 -2.301 0 N-CA-C 116.089 1.885 . . . . 0.0 116.089 -177.856 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.674 ' CD1' ' HD3' ' A' ' 112' ' ' PRO . 0.5 OUTLIER -98.86 179.88 4.5 Favored 'General case' 0 N--CA 1.407 -2.621 0 CA-C-N 114.961 -1.018 . . . . 0.0 108.308 -179.974 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . 0.619 ' H ' HD23 ' A' ' 106' ' ' LEU . 19.5 ttm -94.95 134.58 37.46 Favored 'General case' 1 N--CA 1.347 -5.621 0 CA-C-O 122.027 0.918 . . . . 0.0 109.846 178.08 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -64.32 123.63 19.65 Favored 'General case' 0 N--CA 1.393 -3.319 0 CA-C-N 113.316 -1.766 . . . . 0.0 111.267 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 112.33 -19.01 22.73 Favored Glycine 0 N--CA 1.405 -3.371 0 C-N-CA 119.911 -1.138 . . . . 0.0 111.626 178.463 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.492 ' HG2' ' O ' ' A' ' 107' ' ' MET . 2.6 pt20 -116.6 164.52 14.48 Favored 'General case' 0 N--CA 1.406 -2.628 0 C-N-CA 119.966 -0.694 . . . . 0.0 109.64 178.435 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -135.94 144.9 50.37 Favored Pre-proline 0 C--N 1.29 -1.985 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.15 -179.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . 0.674 ' HD3' ' CD1' ' A' ' 106' ' ' LEU . 36.3 Cg_exo -42.7 132.63 5.47 Favored 'Trans proline' 0 CA--C 1.457 -3.327 0 C-N-CA 125.216 3.944 . . . . 0.0 113.427 177.305 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.523 HD11 HD21 ' A' ' 71' ' ' LEU . 3.2 mp -93.11 106.53 18.05 Favored 'Isoleucine or valine' 1 N--CA 1.368 -4.541 0 CA-C-N 113.302 -1.772 . . . . 0.0 106.527 177.73 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . 0.428 ' HB1' ' CG2' ' A' ' 29' ' ' THR . . . -91.08 127.7 36.61 Favored 'General case' 0 N--CA 1.406 -2.649 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 177.53 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 15.2 tpt180 -121.63 129.79 53.05 Favored 'General case' 0 C--N 1.271 -2.817 0 N-CA-C 105.732 -1.951 . . . . 0.0 105.732 -177.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? -82.28 168.34 17.7 Favored 'General case' 0 C--N 1.272 -2.793 0 C-N-CA 119.687 -0.805 . . . . 0.0 109.014 176.476 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.645 HG21 ' O ' ' A' ' 25' ' ' ARG . 65.4 t . . . . . 0 C--N 1.316 -0.871 0 CA-C-O 122.03 0.919 . . . . 0.0 111.157 -178.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.5 mtt . . . . . 0 CA--C 1.499 -0.987 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -94.55 -179.88 5.04 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 123.628 0.58 . . . . 0.0 109.674 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 55.8 mm-40 60.05 103.11 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.024 1.73 . . . . 0.0 114.064 176.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -62.85 -43.67 98.58 Favored Glycine 0 CA--C 1.508 -0.373 0 N-CA-C 110.959 -0.856 . . . . 0.0 110.959 176.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -101.66 151.9 18.64 Favored Glycine 0 N--CA 1.427 -1.935 0 N-CA-C 107.868 -2.093 . . . . 0.0 107.868 173.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 70.8 -168.93 0.16 Allowed 'General case' 0 C--O 1.242 0.686 0 C-N-CA 123.572 0.749 . . . . 0.0 111.083 -177.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.526 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . -102.73 158.98 15.88 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.877 -178.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.671 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 10.9 t70 -70.2 151.53 45.27 Favored 'General case' 0 CA--C 1.482 -1.658 0 N-CA-C 107.403 -1.332 . . . . 0.0 107.403 173.322 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 19.0 mt -60.25 -38.06 82.32 Favored 'General case' 0 C--N 1.305 -1.334 0 CA-C-O 121.083 0.468 . . . . 0.0 110.887 -175.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -62.14 -31.45 71.93 Favored 'General case' 0 N--CA 1.488 1.473 0 CA-C-N 114.463 -1.244 . . . . 0.0 108.485 -178.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.585 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 3.9 m -80.01 -49.77 11.34 Favored 'General case' 1 N--CA 1.371 -4.395 0 CA-C-N 113.427 -1.715 . . . . 0.0 110.682 178.291 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.671 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 60.0 mt-30 -51.61 -61.54 2.19 Favored 'General case' 0 C--N 1.347 0.487 0 C-N-CA 123.096 0.558 . . . . 0.0 112.085 -174.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.494 ' HA ' ' CH2' ' A' ' 41' ' ' TRP . 6.8 ppt_? -57.74 -38.84 76.04 Favored 'General case' 0 C--O 1.208 -1.109 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -179.255 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.3 t -77.75 -36.8 50.35 Favored 'General case' 0 C--N 1.282 -2.337 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.549 -175.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.486 ' O ' ' HB ' ' A' ' 18' ' ' THR . 9.8 t70 -70.29 -41.39 73.42 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.464 0.65 . . . . 0.0 109.632 -177.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.567 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 44.7 mm -71.27 -31.89 45.4 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.906 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.306 178.28 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.99 -30.73 71.14 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.978 0.894 . . . . 0.0 108.695 177.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.499 ' HA ' ' HE2' ' A' ' 21' ' ' LYS . 1.0 OUTLIER -71.59 -25.96 62.4 Favored 'General case' 0 N--CA 1.4 -2.96 0 CA-C-N 114.198 -1.365 . . . . 0.0 110.488 178.179 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.519 ' HB3' ' CG ' ' A' ' 93' ' ' PRO . 76.6 mt -85.2 -17.54 36.8 Favored 'General case' 0 C--N 1.282 -2.349 0 CA-C-O 121.038 0.447 . . . . 0.0 111.311 -177.268 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.567 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 12.3 mt -86.11 -26.71 25.1 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 -179.328 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.499 ' HE2' ' HA ' ' A' ' 18' ' ' THR . 0.0 OUTLIER -91.72 -5.34 53.83 Favored 'General case' 0 N--CA 1.432 -1.333 0 CA-C-N 114.458 -1.246 . . . . 0.0 110.344 177.692 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.447 ' HB ' ' HA ' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -76.43 138.82 40.58 Favored 'General case' 0 N--CA 1.415 -2.182 0 CA-C-N 113.2 -1.818 . . . . 0.0 110.868 178.727 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 71.2 m -57.56 142.96 42.77 Favored 'General case' 0 C--N 1.283 -2.318 0 CA-C-N 113.086 -1.87 . . . . 0.0 111.699 179.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.651 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP 0.296 0.5 OUTLIER -91.33 -27.07 18.62 Favored 'General case' 0 CA--C 1.465 -2.324 0 N-CA-C 116.743 2.127 . . . . 0.0 116.743 -175.315 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.511 ' O ' HG21 ' A' ' 117' ' ' VAL . 0.0 OUTLIER 63.67 112.01 0.03 OUTLIER 'General case' 0 C--N 1.249 -3.789 0 C-N-CA 127.782 2.433 . . . . 0.0 111.899 179.144 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -60.95 113.04 2.31 Favored 'General case' 0 C--N 1.292 -1.92 0 CA-C-O 121.233 0.539 . . . . 0.0 111.972 -177.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 103.16 7.57 43.3 Favored Glycine 0 N--CA 1.437 -1.29 0 CA-C-N 115.074 -0.966 . . . . 0.0 112.3 -177.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.478 ' HB2' ' HB2' ' A' ' 25' ' ' ARG . 4.8 t70 -87.39 -177.7 6.0 Favored 'General case' 0 C--O 1.248 1.013 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.473 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 40.3 m -126.74 118.06 23.95 Favored 'General case' 0 N--CA 1.424 -1.773 0 CA-C-O 121.427 0.632 . . . . 0.0 110.285 -176.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.651 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 18.2 m95 -107.01 164.72 11.9 Favored 'General case' 0 C--N 1.288 -2.084 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 178.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.415 ' O ' ' HA ' ' A' ' 91' ' ' LEU . 86.7 m-85 -122.43 137.51 54.84 Favored 'General case' 0 C--N 1.278 -2.501 0 N-CA-C 110.329 -0.249 . . . . 0.0 110.329 -178.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.46 ' CD1' ' HB2' ' A' ' 115' ' ' ARG . 9.5 mp -78.74 152.3 31.6 Favored 'General case' 0 C--N 1.309 -1.171 0 C-N-CA 120.275 -0.57 . . . . 0.0 111.626 178.586 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.5 HG12 ' O ' ' A' ' 34' ' ' ASP . 7.2 t -137.75 142.06 37.33 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.624 0 N-CA-C 105.691 -1.966 . . . . 0.0 105.691 172.208 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.5 ' O ' HG12 ' A' ' 33' ' ' VAL . 3.7 p-10 -71.05 141.12 50.9 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 173.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 33.5 p -69.48 -22.21 63.64 Favored 'General case' 0 C--N 1.285 -2.202 0 C-N-CA 120.404 -0.518 . . . . 0.0 111.814 -173.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 90.9 mtt180 -73.37 -40.58 64.25 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.005 -173.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.437 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 71.7 t90 -63.66 -48.05 78.79 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 108.28 -1.008 . . . . 0.0 108.28 178.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.535 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 32.6 t80 -63.29 -43.61 97.38 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-N 114.793 -1.094 . . . . 0.0 110.802 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.471 ' HA ' ' HE2' ' A' ' 42' ' ' LYS . 94.7 mttt -63.02 -34.12 76.88 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 176.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.437 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 17.7 tp60 -65.35 -43.87 89.51 Favored 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 172.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.494 ' CH2' ' HA ' ' A' ' 13' ' ' ARG . 65.6 t90 -58.94 -41.97 88.67 Favored 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 114.778 -1.101 . . . . 0.0 110.872 177.609 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.535 ' HG3' ' O ' ' A' ' 38' ' ' PHE . 40.4 mtmt -54.02 -41.89 68.51 Favored 'General case' 0 CA--C 1.507 -0.708 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 179.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -63.41 -49.31 74.28 Favored 'General case' 0 CA--C 1.504 -0.819 0 O-C-N 124.111 0.882 . . . . 0.0 109.89 178.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.592 ' HB2' HG23 ' A' ' 60' ' ' VAL . 0.1 OUTLIER -66.08 -41.4 90.73 Favored 'General case' 0 N--CA 1.427 -1.619 0 CA-C-N 114.257 -1.338 . . . . 0.0 112.003 -173.792 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.434 HG12 ' O ' ' A' ' 41' ' ' TRP . 5.7 p -90.36 -21.23 6.71 Favored 'Isoleucine or valine' 0 N--CA 1.395 -3.178 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.513 -174.269 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.638 ' HA2' ' HG3' ' A' ' 52' ' ' LYS . . . 84.78 33.05 19.9 Favored Glycine 0 N--CA 1.418 -2.51 0 C-N-CA 120.32 -0.943 . . . . 0.0 111.162 -175.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.419 ' HB3' ' HA ' ' A' ' 42' ' ' LYS . 49.9 t80 -74.67 -41.3 60.54 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -88.25 121.36 30.56 Favored 'General case' 0 C--N 1.311 -1.077 0 N-CA-C 107.144 -1.428 . . . . 0.0 107.144 -178.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 31.6 m -60.13 -15.82 26.99 Favored 'General case' 0 C--N 1.297 -1.709 0 N-CA-C 117.323 2.342 . . . . 0.0 117.323 -168.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 63.6 p-90 -104.07 -9.47 18.75 Favored 'General case' 0 N--CA 1.379 -3.986 0 CA-C-N 120.484 1.493 . . . . 0.0 107.67 -177.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -122.13 73.5 1.1 Allowed 'General case' 0 N--CA 1.423 -1.78 0 CA-C-N 114.954 -1.021 . . . . 0.0 109.844 -165.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.638 ' HG3' ' HA2' ' A' ' 46' ' ' GLY . 0.0 OUTLIER -121.5 28.29 7.8 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.179 177.829 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -81.81 -26.34 34.43 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 175.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.611 ' HB3' HG11 ' A' ' 60' ' ' VAL . 11.2 mm100 -97.83 0.94 47.67 Favored 'General case' 0 N--CA 1.413 -2.298 0 CA-C-N 114.35 -1.295 . . . . 0.0 109.995 -178.151 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . 0.424 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 14.3 tmm? -64.95 116.97 6.93 Favored 'General case' 0 N--CA 1.414 -2.252 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.608 -177.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 83.36 3.85 89.77 Favored Glycine 0 N--CA 1.431 -1.692 0 CA-C-N 114.468 -1.242 . . . . 0.0 111.692 -179.193 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.598 ' HB3' HG22 ' A' ' 60' ' ' VAL . 5.5 t0 -82.07 147.1 29.3 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 -176.408 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -84.33 -22.3 30.65 Favored 'General case' 0 C--N 1.296 -1.751 0 CA-C-O 121.347 0.594 . . . . 0.0 110.64 -178.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -60.8 -31.77 71.14 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 121.925 0.869 . . . . 0.0 110.783 -179.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.611 HG11 ' HB3' ' A' ' 54' ' ' GLN . 27.9 m -105.99 8.49 9.66 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.123 0 CA-C-N 114.457 -1.247 . . . . 0.0 111.881 -172.729 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -60.12 119.04 38.51 Favored Pre-proline 0 C--N 1.304 -1.41 0 O-C-N 124.258 0.974 . . . . 0.0 109.349 179.326 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_endo -88.07 112.9 0.77 Allowed 'Trans proline' 0 N--CA 1.415 -3.113 0 C-N-CA 122.385 2.057 . . . . 0.0 108.905 174.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -68.7 -139.47 0.08 OUTLIER Glycine 0 C--N 1.288 -2.138 0 CA-C-N 114.926 -1.034 . . . . 0.0 112.56 176.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.46 ' HA ' ' O ' ' A' ' 104' ' ' TYR . 28.7 Cg_exo -64.32 137.42 55.85 Favored 'Trans proline' 0 C--O 1.248 0.988 0 C-N-CA 122.075 1.85 . . . . 0.0 112.048 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 65.2 mt -60.01 124.15 13.82 Favored 'Isoleucine or valine' 0 C--O 1.242 0.685 0 C-N-CA 123.389 0.676 . . . . 0.0 110.345 -178.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -116.58 104.56 11.53 Favored 'General case' 0 CA--C 1.501 -0.934 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -172.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.617 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 45.6 m-80 -95.0 12.43 28.47 Favored 'General case' 0 C--N 1.295 -1.778 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.567 -176.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 49.6 m -56.55 -34.7 67.35 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -177.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -72.26 -16.15 77.04 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 121.506 -0.378 . . . . 0.0 112.404 178.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 48.0 mt -93.28 -31.52 14.67 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 178.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.617 ' HG ' ' O ' ' A' ' 67' ' ' ASN . 70.0 mt -76.45 146.02 38.87 Favored 'General case' 0 N--CA 1.433 -1.286 0 CA-C-N 114.65 -1.159 . . . . 0.0 110.646 -176.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 62.8 mttt -70.54 171.77 9.66 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 -177.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -75.35 101.28 4.69 Favored 'General case' 0 C--N 1.297 -1.676 0 CA-C-N 113.442 -1.708 . . . . 0.0 109.115 -179.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 114.04 -36.42 4.01 Favored Glycine 0 N--CA 1.432 -1.633 0 C-N-CA 120.218 -0.992 . . . . 0.0 113.243 177.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -118.74 131.0 56.12 Favored 'General case' 0 CA--C 1.49 -1.333 0 CA-C-N 117.16 0.48 . . . . 0.0 110.655 -177.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.444 ' HA ' HD13 ' A' ' 71' ' ' LEU . . . -88.95 3.29 51.99 Favored 'General case' 0 C--N 1.3 -1.552 0 CA-C-O 121.925 0.869 . . . . 0.0 110.028 179.264 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 6.8 mm100 -117.04 5.58 12.83 Favored 'General case' 0 C--N 1.285 -2.203 0 CA-C-O 122.147 0.975 . . . . 0.0 108.791 -174.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 35.8 m -122.65 125.07 44.88 Favored 'General case' 0 C--N 1.281 -2.381 0 CA-C-N 114.007 -1.451 . . . . 0.0 109.75 -176.538 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.432 HD22 ' N ' ' A' ' 79' ' ' LEU . 2.4 mm? -85.02 151.1 24.42 Favored 'General case' 0 N--CA 1.428 -1.531 0 C-N-CA 123.361 0.664 . . . . 0.0 110.241 178.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.537 ' HB2' ' CD1' ' A' ' 83' ' ' LEU . 99.2 mttt -76.92 168.13 20.62 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-O 121.285 0.564 . . . . 0.0 111.377 176.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -74.25 -45.91 44.86 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 114.678 1.362 . . . . 0.0 114.678 -172.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 26.4 m-70 -81.3 -0.16 39.71 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -167.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.55 ' HB3' ' CE2' ' A' ' 89' ' ' TYR . 8.9 mp -57.3 133.02 54.76 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -179.56 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.676 HG21 HD12 ' A' ' 87' ' ' LEU . 49.5 mt -129.82 174.53 12.46 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.379 0 N-CA-C 104.926 -2.25 . . . . 0.0 104.926 177.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.463 ' N ' HG22 ' A' ' 84' ' ' ILE . 62.4 t0 -57.12 -151.82 0.0 OUTLIER 'General case' 0 CA--C 1.594 2.657 0 C-N-CA 126.58 1.952 . . . . 0.0 110.412 179.167 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.722 ' HA ' ' O ' ' A' ' 89' ' ' TYR 0.322 0.0 OUTLIER -39.24 -17.81 0.01 OUTLIER 'General case' 1 N--CA 1.545 4.321 0 N-CA-C 117.884 2.55 . . . . 0.0 117.884 -172.558 . . . . . . . . 5 4 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.676 HD12 HG21 ' A' ' 84' ' ' ILE . 31.5 mt -60.8 -46.26 91.18 Favored 'General case' 0 C--N 1.278 -2.531 0 C-N-CA 124.683 1.193 . . . . 0.0 110.112 171.143 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -114.69 -45.8 2.98 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-O 121.407 0.623 . . . . 0.0 109.452 -178.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . 0.722 ' O ' ' HA ' ' A' ' 86' ' ' GLU . 2.0 p90 -138.27 -169.45 2.59 Favored 'General case' 1 C--O 1.139 -4.72 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 -176.114 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.423 HD13 HG21 ' A' ' 90' ' ' ILE . 8.6 mt -149.05 162.85 4.68 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.903 0 N-CA-C 106.03 -1.841 . . . . 0.0 106.03 173.357 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.451 HD13 ' HA ' ' A' ' 32' ' ' LEU . 2.5 mm? -120.12 147.41 44.91 Favored 'General case' 0 N--CA 1.404 -2.77 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 172.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -124.38 153.53 69.05 Favored Pre-proline 0 C--N 1.271 -2.811 0 CA-C-N 114.616 -1.175 . . . . 0.0 108.689 171.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.519 ' CG ' ' HB3' ' A' ' 19' ' ' LEU . 5.3 Cg_endo -63.24 168.18 11.44 Favored 'Trans proline' 0 N--CA 1.432 -2.107 0 N-CA-C 107.668 -1.705 . . . . 0.0 107.668 167.063 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 14.7 m -44.36 -48.14 9.72 Favored 'General case' 0 C--N 1.298 -1.652 0 O-C-N 123.743 0.652 . . . . 0.0 110.93 175.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -67.13 -38.92 86.41 Favored 'General case' 0 CA--C 1.472 -2.054 0 CA-C-N 115.052 -0.976 . . . . 0.0 112.086 -177.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.521 ' O ' ' HG ' ' A' ' 100' ' ' LEU . . . -63.86 -51.08 56.54 Favored Glycine 0 N--CA 1.405 -3.37 0 C-N-CA 120.575 -0.821 . . . . 0.0 111.129 -176.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 63.5 t-105 -59.7 -48.98 79.51 Favored 'General case' 0 C--N 1.292 -1.913 0 CA-C-N 114.198 -1.001 . . . . 0.0 110.273 175.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 -51.52 -38.49 54.36 Favored 'General case' 0 C--O 1.195 -1.79 0 O-C-N 123.389 0.43 . . . . 0.0 111.641 176.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 28.3 mttm -66.03 -50.4 64.33 Favored 'General case' 0 CA--C 1.47 -2.109 0 CA-C-O 121.239 0.542 . . . . 0.0 110.308 -179.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' A' ' 96' ' ' GLY . 67.1 mt -67.61 -31.84 72.14 Favored 'General case' 0 C--N 1.275 -2.66 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.765 -176.116 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.548 ' HA ' ' HA ' ' A' ' 105' ' ' THR . 25.0 t -80.28 -24.83 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.398 -3.032 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.017 175.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 20.4 t -78.24 -35.05 48.8 Favored 'General case' 0 C--N 1.299 -1.626 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 178.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' TRP . . . . . 0.459 ' CE3' HD23 ' A' ' 100' ' ' LEU . 34.7 m0 -82.99 -48.87 10.18 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.311 -177.395 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' TYR . . . . . 0.46 ' O ' ' HA ' ' A' ' 64' ' ' PRO . 60.9 m-85 -130.54 6.74 4.82 Favored 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 -173.159 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.548 ' HA ' ' HA ' ' A' ' 101' ' ' VAL 0.27 11.1 t 48.24 -173.27 0.01 OUTLIER 'General case' 0 C--O 1.236 0.389 0 CA-C-O 123.895 1.807 . . . . 0.0 115.13 -179.71 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -105.15 151.81 23.59 Favored 'General case' 1 C--N 1.236 -4.353 0 CA-C-N 112.213 -2.267 . . . . 0.0 105.724 -174.232 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 54.4 mmm -64.14 155.96 29.95 Favored 'General case' 0 CA--C 1.495 -1.146 0 CA-C-O 121.855 0.836 . . . . 0.0 111.627 175.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 20.1 pm0 -75.15 137.88 41.65 Favored 'General case' 0 N--CA 1.389 -3.5 0 CA-C-N 114.346 -1.297 . . . . 0.0 109.289 178.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 89.72 4.12 73.27 Favored Glycine 0 N--CA 1.422 -2.244 0 CA-C-N 114.999 -1.001 . . . . 0.0 112.267 179.353 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -120.48 169.17 10.58 Favored 'General case' 0 CA--C 1.482 -1.636 0 CA-C-O 121.689 0.756 . . . . 0.0 111.634 -178.45 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -137.76 158.87 70.83 Favored Pre-proline 0 N--CA 1.412 -2.325 0 CA-C-N 114.013 -1.449 . . . . 0.0 107.091 178.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_exo -67.14 134.49 34.15 Favored 'Trans proline' 0 CA--C 1.459 -3.253 0 C-N-CA 122.705 2.27 . . . . 0.0 111.255 175.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 3.7 mp -94.76 107.03 18.87 Favored 'Isoleucine or valine' 1 N--CA 1.377 -4.121 0 CA-C-N 113.654 -1.612 . . . . 0.0 106.97 176.646 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.473 ' HB1' ' CG2' ' A' ' 29' ' ' THR . . . -94.02 128.4 40.36 Favored 'General case' 0 N--CA 1.41 -2.452 0 CA-C-O 121.94 0.876 . . . . 0.0 111.124 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.46 ' HB2' ' CD1' ' A' ' 32' ' ' LEU . 17.0 tpt180 -119.69 120.5 36.8 Favored 'General case' 0 C--N 1.28 -2.43 0 CA-C-N 113.909 -1.496 . . . . 0.0 108.085 -175.682 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -67.81 155.94 38.19 Favored 'General case' 0 N--CA 1.424 -1.741 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 172.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.511 HG21 ' O ' ' A' ' 25' ' ' ARG . 90.8 t -60.54 146.21 11.34 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.699 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 175.235 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . 0.471 ' HB ' ' HG2' ' A' ' 120' ' ' GLN . 5.2 m -67.13 150.28 11.17 Favored 'Isoleucine or valine' 0 N--CA 1.392 -3.333 0 CA-C-N 114.382 -1.281 . . . . 0.0 112.517 -175.377 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -95.3 -8.27 36.4 Favored 'General case' 0 C--N 1.285 -2.227 0 CA-C-N 113.838 -1.528 . . . . 0.0 110.392 -171.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.471 ' HG2' ' HB ' ' A' ' 118' ' ' VAL . 17.5 pt20 . . . . . 0 C--N 1.305 -1.33 0 CA-C-N 114.107 -1.406 . . . . 0.0 111.536 177.331 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 mpt? . . . . . 0 CA--C 1.5 -0.95 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -82.48 96.76 8.11 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 178.563 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -89.95 109.17 20.21 Favored 'General case' 0 C--N 1.296 -1.76 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.857 -177.299 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -155.41 10.49 0.36 Allowed Glycine 0 C--N 1.298 -1.57 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.416 177.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -84.76 86.16 1.56 Allowed Glycine 0 N--CA 1.441 -0.995 0 N-CA-C 111.394 -0.682 . . . . 0.0 111.394 -176.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.629 ' HA ' ' CD1' ' A' ' 103' ' ' TRP . . . -89.0 136.24 33.12 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-O 121.063 0.458 . . . . 0.0 112.15 -176.53 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.22 172.11 1.17 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.285 -1.325 . . . . 0.0 112.484 179.387 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.666 ' O ' ' HB ' ' A' ' 11' ' ' THR . 0.6 OUTLIER -62.43 140.07 58.57 Favored 'General case' 0 C--O 1.207 -1.138 0 CA-C-N 114.842 -1.072 . . . . 0.0 108.811 170.298 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.507 ' O ' ' HG3' ' A' ' 13' ' ' ARG . 16.9 mt -61.08 -42.32 98.28 Favored 'General case' 0 CA--C 1.489 -1.4 0 CA-C-O 121.68 0.752 . . . . 0.0 110.77 -174.354 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -64.99 -23.67 67.29 Favored 'General case' 0 C--N 1.292 -1.91 0 CA-C-N 114.424 -1.262 . . . . 0.0 109.464 -177.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.666 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 2.6 m -78.42 -51.65 9.73 Favored 'General case' 0 N--CA 1.389 -3.497 0 CA-C-N 114.722 -1.126 . . . . 0.0 109.761 174.153 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.643 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 52.0 mt-30 -51.58 -53.77 34.57 Favored 'General case' 0 C--N 1.353 0.733 0 C-N-CA 123.528 0.731 . . . . 0.0 111.492 -175.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.547 ' HG2' HG13 ' A' ' 45' ' ' VAL . 45.1 mtm180 -45.06 -58.21 3.35 Favored 'General case' 0 N--CA 1.486 1.374 0 CA-C-O 121.942 0.877 . . . . 0.0 110.598 177.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 74.3 m -66.68 -45.96 77.19 Favored 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 113.735 -1.575 . . . . 0.0 112.769 -172.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.5 t0 -66.28 -39.57 89.49 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.977 -176.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.594 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 26.2 mm -76.07 -37.88 34.03 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.353 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.268 178.36 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.548 ' O ' ' HG2' ' A' ' 21' ' ' LYS . . . -57.79 -39.87 78.53 Favored 'General case' 0 CA--C 1.495 -1.156 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.435 ' HA ' ' HD3' ' A' ' 21' ' ' LYS . 5.7 m -60.22 -36.28 77.34 Favored 'General case' 0 N--CA 1.396 -3.143 0 CA-C-N 113.372 -1.74 . . . . 0.0 112.015 179.401 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.464 ' HB3' ' CG ' ' A' ' 93' ' ' PRO . 71.8 mt -85.65 -13.33 48.92 Favored 'General case' 0 C--N 1.269 -2.918 0 O-C-N 121.611 -0.68 . . . . 0.0 112.495 -176.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.594 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 16.2 mt -86.04 -25.25 26.02 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 177.101 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.548 ' HG2' ' O ' ' A' ' 17' ' ' ALA . 19.6 ptmt -91.42 -22.11 20.62 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.596 -176.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 16.4 m -51.06 134.95 25.98 Favored 'General case' 0 N--CA 1.402 -2.839 0 C-N-CA 125.204 1.402 . . . . 0.0 111.639 174.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 72.8 m -77.47 149.59 35.02 Favored 'General case' 0 N--CA 1.395 -3.2 0 CA-C-N 113.529 -1.669 . . . . 0.0 111.649 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -111.44 168.01 9.87 Favored 'General case' 0 N--CA 1.41 -2.44 0 CA-C-N 115.275 -0.875 . . . . 0.0 112.158 178.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.406 ' O ' HG21 ' A' ' 117' ' ' VAL . 0.0 OUTLIER -143.32 152.26 41.44 Favored 'General case' 0 C--N 1.281 -2.393 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 175.743 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -55.08 128.55 34.23 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 121.094 0.474 . . . . 0.0 110.858 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 113.3 -18.3 20.96 Favored Glycine 0 N--CA 1.424 -2.142 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.533 -177.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -72.28 141.15 48.9 Favored 'General case' 0 CA--C 1.498 -1.023 0 CA-C-N 117.288 0.544 . . . . 0.0 110.637 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 49.0 m -97.59 134.34 40.93 Favored 'General case' 0 C--N 1.294 -1.806 0 N-CA-C 107.448 -1.315 . . . . 0.0 107.448 175.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.425 ' HB3' ' HB3' ' A' ' 91' ' ' LEU . 39.3 m95 -120.12 137.04 54.38 Favored 'General case' 0 C--N 1.282 -2.364 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 179.662 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 67.6 m-85 -98.24 121.66 40.44 Favored 'General case' 0 C--N 1.264 -3.132 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.041 -176.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.782 HD11 ' CD1' ' A' ' 89' ' ' TYR . 15.9 tp -81.07 138.96 35.96 Favored 'General case' 0 N--CA 1.4 -2.933 0 CA-C-N 115.114 -0.948 . . . . 0.0 113.348 -178.588 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.494 HG12 ' O ' ' A' ' 34' ' ' ASP . 58.4 t -132.8 150.67 33.28 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.128 0 C-N-CA 126.126 1.77 . . . . 0.0 107.285 -177.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.684 ' HB2' HD21 ' A' ' 70' ' ' LEU . 6.8 t70 -72.16 136.86 46.61 Favored 'General case' 0 C--N 1.284 -2.264 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 169.553 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.418 ' OG ' ' HE3' ' A' ' 39' ' ' LYS . 29.1 t -68.8 -31.58 70.68 Favored 'General case' 0 C--N 1.3 -1.586 0 CA-C-O 121.028 0.442 . . . . 0.0 111.177 -174.804 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.431 ' HB2' ' OD2' ' A' ' 34' ' ' ASP . 55.7 mtt180 -69.66 -34.16 73.61 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.373 -175.073 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.494 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 76.5 t90 -67.5 -45.48 75.69 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 177.405 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.447 ' CG ' HD12 ' A' ' 90' ' ' ILE . 23.7 t80 -65.18 -39.69 93.24 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.112 -179.203 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.43 ' HA ' ' HD3' ' A' ' 42' ' ' LYS . 98.4 mttt -64.64 -33.68 76.52 Favored 'General case' 0 CA--C 1.506 -0.723 0 CA-C-O 120.898 0.38 . . . . 0.0 111.511 175.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.494 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 24.5 tp60 -64.42 -44.54 90.92 Favored 'General case' 0 N--CA 1.408 -2.571 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 175.6 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 65.1 t90 -60.76 -43.4 98.04 Favored 'General case' 0 C--O 1.217 -0.633 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.396 176.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.594 ' HG2' ' CD1' ' A' ' 47' ' ' PHE . 15.3 mtpp -57.35 -39.29 75.62 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 123.153 0.581 . . . . 0.0 112.109 -178.204 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 40.3 mttp -72.97 -40.29 65.43 Favored 'General case' 0 C--N 1.285 -2.211 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 177.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.606 ' HB2' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -68.76 -38.15 79.88 Favored 'General case' 0 C--N 1.289 -2.049 0 CA-C-N 114.861 -1.063 . . . . 0.0 110.142 -176.956 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.547 HG13 ' HG2' ' A' ' 13' ' ' ARG . 4.3 p -88.79 -17.84 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.626 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.499 -176.258 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.42 ' HA2' ' CB ' ' A' ' 52' ' ' LYS . . . 83.07 27.96 38.95 Favored Glycine 0 N--CA 1.438 -1.227 0 C-N-CA 120.418 -0.896 . . . . 0.0 112.138 -174.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.594 ' CD1' ' HG2' ' A' ' 42' ' ' LYS . 48.8 t80 -72.73 -38.3 67.46 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 176.171 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.461 ' HB2' ' O ' ' A' ' 51' ' ' ASP . 71.4 m-20 -73.82 111.2 8.74 Favored 'General case' 0 CA--C 1.491 -1.289 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 174.213 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 11.0 m -60.95 -37.23 81.66 Favored 'General case' 0 C--N 1.297 -1.677 0 CA-C-O 121.573 0.701 . . . . 0.0 109.694 178.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 49.2 p90 -81.74 -15.55 53.97 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 114.912 -1.04 . . . . 0.0 111.336 -179.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.461 ' O ' ' HB2' ' A' ' 48' ' ' ASP . 7.6 t70 -141.13 86.87 2.06 Favored 'General case' 0 CA--C 1.475 -1.932 0 CA-C-O 122.364 1.078 . . . . 0.0 110.82 -175.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.42 ' CB ' ' HA2' ' A' ' 46' ' ' GLY . 63.7 pttt -142.33 18.77 2.07 Favored 'General case' 0 C--N 1.28 -2.427 0 CA-C-N 113.95 -1.477 . . . . 0.0 110.225 -179.295 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -60.55 -28.43 68.43 Favored 'General case' 0 C--N 1.292 -1.894 0 CA-C-N 112.747 -2.024 . . . . 0.0 107.355 172.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -94.8 11.92 29.82 Favored 'General case' 0 N--CA 1.421 -1.898 0 CA-C-N 113.958 -1.474 . . . . 0.0 111.661 -174.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . 0.498 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 43.8 ttm -59.46 113.04 1.99 Allowed 'General case' 0 N--CA 1.429 -1.503 0 CA-C-O 121.013 0.435 . . . . 0.0 111.059 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.38 4.78 90.04 Favored Glycine 0 N--CA 1.437 -1.296 0 CA-C-N 115.393 -0.821 . . . . 0.0 112.569 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.574 ' HB3' HG22 ' A' ' 60' ' ' VAL . 4.8 t70 -76.46 148.99 36.86 Favored 'General case' 0 CA--C 1.509 -0.596 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 -176.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -83.7 -14.59 51.34 Favored 'General case' 0 C--N 1.299 -1.592 0 CA-C-O 122.117 0.96 . . . . 0.0 109.618 -178.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 33.2 m-80 -65.34 -25.98 67.83 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.551 175.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.606 HG23 ' HB2' ' A' ' 44' ' ' TYR . 34.1 m -119.9 3.19 6.87 Favored 'Isoleucine or valine' 0 CA--C 1.476 -1.871 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -172.354 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.457 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 5.3 p90 -62.43 118.11 37.36 Favored Pre-proline 0 C--N 1.308 -1.228 0 C-N-CA 119.334 -0.946 . . . . 0.0 109.291 178.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 61' ' ' TYR . 10.1 Cg_endo -88.63 111.04 0.6 Allowed 'Trans proline' 0 N--CA 1.418 -2.936 0 C-N-CA 122.397 2.065 . . . . 0.0 110.088 177.48 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -69.66 -153.9 0.88 Allowed Glycine 0 C--N 1.285 -2.286 0 CA-C-N 115.081 -0.963 . . . . 0.0 112.066 175.249 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.511 ' HB2' ' SD ' ' A' ' 107' ' ' MET . 88.6 Cg_exo -51.38 137.61 47.48 Favored 'Trans proline' 0 C--O 1.252 1.183 0 C-N-CA 122.929 2.419 . . . . 0.0 113.031 -179.721 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.424 HG12 ' CZ2' ' A' ' 37' ' ' TRP . 45.9 mt -64.18 110.51 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.012 0 CA-C-N 114.498 -1.228 . . . . 0.0 111.196 -175.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.532 ' HB2' ' HG3' ' A' ' 107' ' ' MET . 17.5 t70 -104.4 115.64 30.73 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.182 177.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -111.53 24.07 13.21 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.778 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 30.2 m -70.59 9.03 0.7 Allowed 'General case' 0 CA--C 1.554 1.133 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 -177.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -109.89 -4.97 29.47 Favored Glycine 0 CA--C 1.496 -1.105 0 C-N-CA 119.14 -1.505 . . . . 0.0 109.782 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.684 HD21 ' HB2' ' A' ' 34' ' ' ASP . 2.2 mm? -98.46 -52.99 3.46 Favored 'General case' 0 N--CA 1.418 -2.026 0 CA-C-N 113.482 -1.359 . . . . 0.0 109.797 -176.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.57 ' HA ' ' HA ' ' A' ' 79' ' ' LEU . 78.7 mt -59.86 147.13 39.5 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.224 -1.353 . . . . 0.0 113.842 -175.521 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.9 mtpt -83.52 -170.75 3.21 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-N 113.98 -1.463 . . . . 0.0 108.968 176.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -88.41 132.29 34.51 Favored 'General case' 0 C--N 1.286 -2.168 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.969 -172.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 82.27 -55.46 4.95 Favored Glycine 0 C--N 1.316 -0.567 0 N-CA-C 115.206 0.842 . . . . 0.0 115.206 173.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -57.46 -49.67 75.52 Favored 'General case' 0 CA--C 1.474 -1.977 0 CA-C-O 122.199 0.999 . . . . 0.0 112.889 -174.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . 58.22 13.59 2.4 Favored 'General case' 0 C--N 1.257 -3.431 0 CA-C-N 112.303 -2.226 . . . . 0.0 113.117 -176.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.544 HE22 ' HB2' ' A' ' 111' ' ' GLU . 23.5 mm-40 -125.03 5.46 7.94 Favored 'General case' 0 CA--C 1.478 -1.8 0 N-CA-C 106.601 -1.629 . . . . 0.0 106.601 177.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.7 m -131.54 122.16 25.66 Favored 'General case' 0 C--N 1.28 -2.446 0 CA-C-N 112.594 -2.094 . . . . 0.0 109.061 -172.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.577 ' HG ' ' CD2' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -103.64 163.31 12.4 Favored 'General case' 0 N--CA 1.423 -1.814 0 O-C-N 123.451 0.469 . . . . 0.0 109.931 176.023 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.484 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 49.2 mtmt -60.59 116.5 4.4 Favored 'General case' 0 C--N 1.293 -1.85 0 CA-C-O 122.116 0.96 . . . . 0.0 111.802 -177.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.413 ' H ' ' CD ' ' A' ' 81' ' ' GLU . 1.2 pm0 -64.39 -8.99 15.22 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 115.027 1.492 . . . . 0.0 115.027 -172.776 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 46.0 m-70 -98.22 0.29 45.51 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 122.135 -0.353 . . . . 0.0 111.491 178.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.484 ' HG ' ' O ' ' A' ' 80' ' ' LYS . 56.6 mt -77.09 133.28 39.08 Favored 'General case' 0 C--O 1.248 1.026 0 CA-C-O 121.178 0.513 . . . . 0.0 109.808 179.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.62 HG21 HD12 ' A' ' 87' ' ' LEU . 49.2 mt -89.0 171.3 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.615 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 178.573 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.645 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 19.3 t70 -59.64 -139.52 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.971 0 C-N-CA 125.953 1.701 . . . . 0.0 111.041 -179.312 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.607 ' HA ' ' O ' ' A' ' 89' ' ' TYR . 0.1 OUTLIER -41.44 -18.82 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.565 0 N-CA-C 117.231 2.308 . . . . 0.0 117.231 -174.204 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.62 HD12 HG21 ' A' ' 84' ' ' ILE . 35.8 mt -60.96 -50.78 72.02 Favored 'General case' 0 C--N 1.292 -1.934 0 CA-C-O 121.57 0.7 . . . . 0.0 109.702 171.588 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -105.51 -45.79 4.35 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.794 -179.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . 0.782 ' CD1' HD11 ' A' ' 32' ' ' LEU . 1.5 p90 -139.09 -176.79 4.63 Favored 'General case' 0 C--O 1.161 -3.564 0 CA-C-O 119.323 -0.37 . . . . 0.0 110.703 -175.544 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.447 HD12 ' CG ' ' A' ' 38' ' ' PHE . 5.4 mt -143.48 151.53 16.8 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.472 0 CA-C-N 119.493 1.042 . . . . 0.0 109.329 176.334 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.498 HD23 ' HA ' ' A' ' 32' ' ' LEU . 64.2 mt -112.67 133.82 54.5 Favored 'General case' 0 N--CA 1.4 -2.961 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.268 175.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.464 HD11 HG21 ' A' ' 33' ' ' VAL . 56.0 mt -121.09 150.77 54.24 Favored Pre-proline 0 C--N 1.281 -2.404 0 CA-C-N 113.744 -1.571 . . . . 0.0 107.366 -178.419 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.464 ' CG ' ' HB3' ' A' ' 19' ' ' LEU . 72.2 Cg_endo -76.21 169.12 22.66 Favored 'Trans proline' 0 N--CA 1.429 -2.27 0 N-CA-C 107.902 -1.615 . . . . 0.0 107.902 172.508 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 58.1 m -38.25 -54.71 1.39 Allowed 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 123.999 0.92 . . . . 0.0 112.988 177.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -71.56 -32.44 68.11 Favored 'General case' 0 CA--C 1.498 -1.025 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -175.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.442 ' O ' ' HG ' ' A' ' 100' ' ' LEU . . . -59.03 -47.69 89.57 Favored Glycine 0 N--CA 1.436 -1.353 0 N-CA-C 109.99 -1.244 . . . . 0.0 109.99 177.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 69.1 t-105 -67.8 -50.05 58.98 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 123.512 0.725 . . . . 0.0 110.114 178.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -53.3 -31.29 43.26 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 179.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 39.7 mttm -68.39 -55.43 12.0 Favored 'General case' 0 CA--C 1.468 -2.206 0 C-N-CA 123.172 0.589 . . . . 0.0 110.309 176.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.481 HD23 ' CE3' ' A' ' 103' ' ' TRP . 80.9 mt -64.32 -32.83 74.59 Favored 'General case' 0 C--N 1.275 -2.635 0 CA-C-N 114.885 -1.052 . . . . 0.0 112.196 -176.076 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.404 ' O ' ' HA ' ' A' ' 105' ' ' THR . 10.3 t -78.02 -25.87 14.41 Favored 'Isoleucine or valine' 0 N--CA 1.401 -2.89 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.247 175.096 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 14.7 t -81.38 -33.87 32.03 Favored 'General case' 0 C--N 1.295 -1.787 0 O-C-N 121.425 -0.797 . . . . 0.0 109.086 178.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' TRP . . . . . 0.629 ' CD1' ' HA ' ' A' ' 6' ' ' ALA . 50.3 m0 -79.93 -45.04 19.25 Favored 'General case' 0 N--CA 1.429 -1.489 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.426 -178.118 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 33.5 m-85 -128.99 -4.05 5.09 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 115.241 1.571 . . . . 0.0 115.241 -174.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.404 ' HA ' ' O ' ' A' ' 101' ' ' VAL 0.279 7.9 p 58.3 167.28 0.05 OUTLIER 'General case' 0 N--CA 1.42 -1.931 0 N-CA-C 116.211 1.93 . . . . 0.0 116.211 -174.941 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 30.2 tp -92.4 157.24 16.7 Favored 'General case' 0 C--N 1.281 -2.411 0 CA-C-N 114.09 -1.414 . . . . 0.0 107.438 176.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.532 ' HG3' ' HB2' ' A' ' 66' ' ' ASP . 62.8 mmm -74.17 156.37 37.39 Favored 'General case' 0 CA--C 1.49 -1.352 0 CA-C-O 121.775 0.798 . . . . 0.0 110.428 174.553 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -89.32 153.56 20.78 Favored 'General case' 0 N--CA 1.394 -3.242 0 CA-C-N 114.32 -1.309 . . . . 0.0 109.2 -179.037 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 101.41 -29.97 11.39 Favored Glycine 0 N--CA 1.415 -2.719 0 C-N-CA 119.873 -1.156 . . . . 0.0 110.965 -176.563 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -117.14 177.09 4.84 Favored 'General case' 0 N--CA 1.421 -1.904 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . 0.544 ' HB2' HE22 ' A' ' 77' ' ' GLN . 49.1 mt-10 -135.09 160.31 68.77 Favored Pre-proline 0 C--N 1.298 -1.661 0 N-CA-C 106.925 -1.509 . . . . 0.0 106.925 -178.36 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -55.99 122.66 12.16 Favored 'Trans proline' 0 CA--C 1.459 -3.256 0 C-N-CA 122.723 2.282 . . . . 0.0 111.054 177.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.416 ' HB ' ' HB3' ' A' ' 32' ' ' LEU . 33.8 mt -79.63 105.93 9.9 Favored 'Isoleucine or valine' 1 N--CA 1.379 -4.002 0 CA-C-N 113.05 -1.887 . . . . 0.0 106.957 -179.375 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -98.22 129.97 44.95 Favored 'General case' 0 C--N 1.266 -3.065 0 CA-C-O 121.913 0.863 . . . . 0.0 110.767 -178.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.541 ' NE ' ' HA ' ' A' ' 115' ' ' ARG . 4.0 mmp_? -124.33 -174.47 3.02 Favored 'General case' 0 N--CA 1.395 -3.209 0 N-CA-C 105.111 -2.181 . . . . 0.0 105.111 176.552 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 61.3 pttt -153.01 173.85 14.9 Favored 'General case' 0 C--N 1.254 -3.566 0 C-N-CA 119.822 -0.751 . . . . 0.0 109.658 -177.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.406 HG21 ' O ' ' A' ' 25' ' ' ARG . 21.4 t -66.54 138.26 23.3 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.791 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 172.613 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 27.9 m -84.71 175.72 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.267 -2.998 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.627 -174.191 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -98.88 6.45 46.79 Favored 'General case' 0 C--N 1.294 -1.813 0 CA-C-N 115.01 -0.995 . . . . 0.0 111.178 -179.155 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 . . . . . 0 C--N 1.304 -1.374 0 CA-C-N 113.794 -1.548 . . . . 0.0 107.618 176.813 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.421 ' SD ' ' N ' ' A' ' 2' ' ' ALA . 0.0 OUTLIER . . . . . 0 CA--C 1.515 -0.392 0 N-CA-C 105.044 -2.206 . . . . 0.0 105.044 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.421 ' N ' ' SD ' ' A' ' 1' ' ' MET . . . 66.92 36.71 4.23 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-O 122.248 1.023 . . . . 0.0 108.666 -175.324 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -63.1 147.34 51.06 Favored 'General case' 0 C--O 1.252 1.188 0 CA-C-N 113.333 -1.758 . . . . 0.0 110.089 -178.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -88.58 -68.91 1.27 Allowed Glycine 0 N--CA 1.435 -1.422 0 N-CA-C 111.32 -0.712 . . . . 0.0 111.32 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -167.8 109.06 0.32 Allowed Glycine 0 N--CA 1.437 -1.298 0 N-CA-C 111.232 -0.747 . . . . 0.0 111.232 178.182 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -137.71 165.45 26.38 Favored 'General case' 0 C--N 1.301 -1.504 0 CA-C-N 116.889 0.345 . . . . 0.0 110.58 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.466 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . -79.22 172.9 13.16 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.525 -179.591 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.66 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 15.0 t70 -67.4 145.47 55.02 Favored 'General case' 0 CA--C 1.483 -1.605 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 175.199 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.407 ' O ' ' HG2' ' A' ' 13' ' ' ARG . 38.1 mt -55.07 -41.79 71.96 Favored 'General case' 0 CA--C 1.494 -1.18 0 CA-C-N 119.03 0.832 . . . . 0.0 110.234 -177.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -69.0 -35.9 77.22 Favored 'General case' 0 CA--C 1.494 -1.206 0 CA-C-N 114.461 -1.245 . . . . 0.0 109.989 -177.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.5 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 5.4 m -65.2 -52.37 55.15 Favored 'General case' 0 N--CA 1.389 -3.522 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.028 177.042 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.66 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 79.1 mt-30 -49.31 -54.07 18.84 Favored 'General case' 0 CA--C 1.504 -0.806 0 C-N-CA 124.444 1.097 . . . . 0.0 111.934 -177.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.407 ' HG2' ' O ' ' A' ' 9' ' ' LEU . 10.7 ptt180 -64.01 -43.46 95.55 Favored 'General case' 0 N--CA 1.434 -1.256 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.646 -174.29 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 44.7 m -69.27 -44.52 71.71 Favored 'General case' 0 C--N 1.288 -2.07 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.244 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -63.81 -37.54 87.75 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.023 0.929 . . . . 0.0 109.962 -175.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.529 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 34.7 mm -78.97 -37.45 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.164 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.299 177.8 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.72 -36.71 77.11 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 -178.146 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 1.3 m -62.48 -32.95 73.93 Favored 'General case' 0 N--CA 1.412 -2.353 0 C-N-CA 124.786 1.234 . . . . 0.0 111.757 177.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 69.0 mt -85.86 -14.01 46.24 Favored 'General case' 0 C--N 1.278 -2.53 0 O-C-N 121.251 -0.906 . . . . 0.0 111.7 -177.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 14.3 mt -84.67 -26.13 27.99 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 177.113 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.406 ' H ' ' HG3' ' A' ' 21' ' ' LYS . 0.1 OUTLIER -91.39 -13.95 31.51 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-O 122.275 1.036 . . . . 0.0 111.348 -176.859 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 5.6 m -72.33 145.06 48.05 Favored 'General case' 0 N--CA 1.402 -2.869 0 CA-C-N 113.67 -1.604 . . . . 0.0 109.386 173.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.7 t -100.58 161.68 13.44 Favored 'General case' 0 N--CA 1.401 -2.891 0 CA-C-O 121.7 0.762 . . . . 0.0 110.628 -176.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.651 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP . 0.5 OUTLIER -99.46 167.68 10.46 Favored 'General case' 0 C--N 1.294 -1.826 0 CA-C-N 114.57 -1.196 . . . . 0.0 112.829 179.782 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -104.88 -157.45 0.61 Allowed 'General case' 0 C--N 1.291 -1.948 0 N-CA-C 105.939 -1.874 . . . . 0.0 105.939 176.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.46 ' C ' HG21 ' A' ' 117' ' ' VAL . 16.1 ptpt -119.39 29.98 7.35 Favored 'General case' 0 N--CA 1.414 -2.259 0 CA-C-O 121.478 0.656 . . . . 0.0 110.352 172.095 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.502 ' N ' HG21 ' A' ' 117' ' ' VAL . . . -149.78 20.34 1.14 Allowed Glycine 0 CA--C 1.54 1.618 0 CA-C-N 114.831 -1.077 . . . . 0.0 114.165 176.223 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.441 ' H ' HG11 ' A' ' 117' ' ' VAL . 10.9 m-20 -96.15 -174.48 3.1 Favored 'General case' 0 N--CA 1.491 1.588 0 CA-C-N 118.544 1.172 . . . . 0.0 110.055 -178.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.405 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 90.1 m -133.71 127.44 32.84 Favored 'General case' 0 N--CA 1.425 -1.698 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 170.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.651 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 17.1 m95 -114.33 163.72 14.9 Favored 'General case' 0 C--N 1.277 -2.584 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.453 ' HB2' ' HB2' ' A' ' 97' ' ' TRP . 89.1 m-85 -123.46 141.87 51.57 Favored 'General case' 0 C--N 1.278 -2.505 0 C-N-CA 121.069 -0.252 . . . . 0.0 111.507 -175.605 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.618 HD13 HG22 ' A' ' 113' ' ' ILE . 5.5 mp -92.04 134.64 34.63 Favored 'General case' 0 CA--C 1.461 -2.452 0 O-C-N 124.54 1.15 . . . . 0.0 111.512 -179.71 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.438 HG12 ' O ' ' A' ' 34' ' ' ASP . 95.8 t -116.52 142.65 29.21 Favored 'Isoleucine or valine' 0 C--N 1.251 -3.69 0 N-CA-C 102.932 -2.988 . . . . 0.0 102.932 171.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.438 ' O ' HG12 ' A' ' 33' ' ' VAL . 10.2 p-10 -72.75 136.7 45.55 Favored 'General case' 0 C--N 1.278 -2.541 0 N-CA-C 106.897 -1.52 . . . . 0.0 106.897 174.004 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 61.9 p -62.3 -28.36 69.68 Favored 'General case' 0 C--N 1.272 -2.802 0 CA-C-N 114.278 -1.328 . . . . 0.0 110.024 -173.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.9 mmt85 -69.96 -45.78 66.67 Favored 'General case' 0 N--CA 1.423 -1.824 0 CA-C-N 114.02 -1.446 . . . . 0.0 110.058 -173.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.522 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 69.1 t90 -67.61 -44.19 78.65 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 179.36 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.446 ' CG ' HD12 ' A' ' 90' ' ' ILE . 38.4 t80 -61.86 -37.83 85.99 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.185 -178.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -73.78 -23.66 59.73 Favored 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 121.693 -0.629 . . . . 0.0 112.627 178.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.522 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 24.5 tp60 -70.29 -42.61 71.84 Favored 'General case' 0 N--CA 1.412 -2.341 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 172.114 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.447 ' O ' HG22 ' A' ' 45' ' ' VAL . 78.4 t90 -62.31 -39.39 92.88 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-N 114.241 -1.345 . . . . 0.0 110.529 176.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.535 ' HG2' ' CD2' ' A' ' 47' ' ' PHE . 11.5 mtpp -55.57 -46.77 77.16 Favored 'General case' 0 CA--C 1.498 -1.032 0 C-N-CA 123.265 0.626 . . . . 0.0 111.683 178.475 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -57.66 -52.5 65.19 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 124.766 1.291 . . . . 0.0 110.727 178.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.649 ' HB2' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -60.61 -36.42 78.56 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 113.594 -1.639 . . . . 0.0 114.226 -175.241 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.447 HG22 ' O ' ' A' ' 41' ' ' TRP . 18.8 m -95.95 -17.26 6.99 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.781 0 N-CA-C 113.234 0.827 . . . . 0.0 113.234 -178.842 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.568 ' HA2' ' CB ' ' A' ' 52' ' ' LYS . . . 79.79 38.12 20.92 Favored Glycine 0 N--CA 1.4 -3.743 0 C-N-CA 119.949 -1.12 . . . . 0.0 110.967 -172.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.535 ' CD2' ' HG2' ' A' ' 42' ' ' LYS . 75.9 t80 -63.22 -40.43 97.44 Favored 'General case' 0 N--CA 1.442 -0.827 0 C-N-CA 123.022 0.529 . . . . 0.0 111.562 -176.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.663 ' HB3' ' HB3' ' A' ' 51' ' ' ASP . 3.5 t70 -92.3 -178.95 5.09 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 -174.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . 0.463 ' O ' ' HE2' ' A' ' 52' ' ' LYS . 20.8 m -84.94 -37.17 20.85 Favored 'General case' 0 C--N 1.294 -1.822 0 N-CA-C 111.755 0.279 . . . . 0.0 111.755 -176.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 66.7 p-90 -105.13 -21.14 13.32 Favored 'General case' 0 N--CA 1.39 -3.471 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 -178.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.663 ' HB3' ' HB3' ' A' ' 48' ' ' ASP . 31.7 t0 -94.98 73.29 3.46 Favored 'General case' 0 CA--C 1.461 -2.449 0 CA-C-N 114.071 -1.422 . . . . 0.0 108.776 -170.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.568 ' CB ' ' HA2' ' A' ' 46' ' ' GLY . 65.2 pttt -162.39 9.68 0.06 Allowed 'General case' 0 N--CA 1.415 -2.192 0 CA-C-N 112.689 -2.051 . . . . 0.0 114.058 -174.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -63.53 -22.9 67.15 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-O 122.639 1.209 . . . . 0.0 108.101 171.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.472 ' HB3' HG11 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -94.48 11.34 31.13 Favored 'General case' 0 N--CA 1.427 -1.594 0 CA-C-N 113.426 -1.715 . . . . 0.0 110.858 -175.817 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 46.5 ttm -62.11 115.13 3.85 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 110.067 -0.345 . . . . 0.0 110.067 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.03 20.55 77.5 Favored Glycine 0 N--CA 1.44 -1.094 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.824 -179.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.525 ' HB3' HG22 ' A' ' 60' ' ' VAL . 5.7 t0 -91.83 147.6 22.86 Favored 'General case' 0 CA--C 1.503 -0.846 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 -179.302 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.442 ' O ' ' HD2' ' A' ' 61' ' ' TYR . 19.4 pt20 -83.21 -17.56 42.35 Favored 'General case' 0 C--N 1.296 -1.72 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 -62.39 -25.26 67.83 Favored 'General case' 0 CA--C 1.492 -1.27 0 CA-C-N 115.043 -0.981 . . . . 0.0 111.41 177.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.649 HG23 ' HB2' ' A' ' 44' ' ' TYR . 26.5 m -121.19 7.44 6.07 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.824 0 CA-C-N 115.028 -0.987 . . . . 0.0 112.099 -172.401 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.442 ' HD2' ' O ' ' A' ' 58' ' ' GLN . 0.9 OUTLIER -62.73 116.53 24.41 Favored Pre-proline 0 C--N 1.305 -1.342 0 O-C-N 124.052 0.845 . . . . 0.0 111.067 -178.419 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 61' ' ' TYR . 15.0 Cg_endo -89.78 117.97 0.75 Allowed 'Trans proline' 0 N--CA 1.41 -3.399 0 C-N-CA 122.699 2.266 . . . . 0.0 111.422 177.555 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -73.45 -153.67 2.64 Favored Glycine 0 C--N 1.273 -2.95 0 CA-C-N 113.806 -1.543 . . . . 0.0 111.253 171.046 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.4 ' HB2' ' SD ' ' A' ' 107' ' ' MET . 52.3 Cg_exo -55.83 143.06 82.76 Favored 'Trans proline' 0 C--O 1.245 0.859 0 C-N-CA 122.82 2.347 . . . . 0.0 112.662 -178.547 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.444 HD11 ' HB3' ' A' ' 100' ' ' LEU . 42.2 mt -64.95 114.07 2.3 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.115 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.82 -176.768 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.582 ' HB2' ' HG3' ' A' ' 107' ' ' MET . 24.4 t70 -113.35 104.96 12.83 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 116.022 -0.535 . . . . 0.0 109.769 178.687 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -91.22 19.51 5.84 Favored 'General case' 0 C--N 1.303 -1.419 0 CA-C-N 116.925 -0.125 . . . . 0.0 111.245 -176.12 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 33.2 t -54.75 -31.66 58.8 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -176.004 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -66.06 -18.25 66.62 Favored Glycine 0 CA--C 1.527 0.79 0 C-N-CA 121.296 -0.478 . . . . 0.0 113.446 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 32.1 mt -93.61 -21.61 19.3 Favored 'General case' 0 C--O 1.247 0.928 0 CA-C-O 121.395 0.617 . . . . 0.0 109.388 179.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.555 HD13 ' HA ' ' A' ' 76' ' ' ALA . 50.3 mt -79.87 137.6 36.97 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.713 -173.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -78.43 -174.62 3.87 Favored 'General case' 0 C--O 1.246 0.891 0 CA-C-O 122.264 1.031 . . . . 0.0 111.135 178.24 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -95.25 93.79 7.5 Favored 'General case' 0 N--CA 1.423 -1.825 0 N-CA-C 106.142 -1.799 . . . . 0.0 106.142 172.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 179.27 -64.95 0.08 OUTLIER Glycine 0 N--CA 1.425 -2.075 0 N-CA-C 110.012 -1.235 . . . . 0.0 110.012 -177.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -148.37 170.59 17.62 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 177.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.555 ' HA ' HD13 ' A' ' 71' ' ' LEU . . . -83.66 2.04 39.5 Favored 'General case' 0 C--N 1.3 -1.572 0 CA-C-O 121.939 0.876 . . . . 0.0 109.629 177.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 23.2 mm-40 -114.94 3.13 14.45 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.238 178.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 94.7 p -98.13 113.04 24.81 Favored 'General case' 0 C--N 1.297 -1.683 0 CA-C-N 115.164 -0.926 . . . . 0.0 111.343 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.593 HD11 HG21 ' A' ' 113' ' ' ILE . 3.0 mm? -93.68 141.87 28.0 Favored 'General case' 0 N--CA 1.425 -1.705 0 C-N-CA 123.867 0.867 . . . . 0.0 111.459 -179.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -61.69 139.27 58.32 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.318 0.58 . . . . 0.0 111.163 175.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.566 ' H ' ' CD ' ' A' ' 81' ' ' GLU . 0.4 OUTLIER -58.56 -48.07 82.11 Favored 'General case' 0 C--N 1.301 -1.501 0 C-N-CA 124.838 1.255 . . . . 0.0 110.139 -176.445 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 71.9 m80 -84.85 12.06 8.11 Favored 'General case' 0 C--N 1.295 -1.793 0 CA-C-N 113.971 -1.468 . . . . 0.0 114.053 -170.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 74.9 mt -60.49 119.59 8.32 Favored 'General case' 0 C--O 1.24 0.604 0 CA-C-O 120.879 0.371 . . . . 0.0 111.965 178.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.74 HG21 HD12 ' A' ' 87' ' ' LEU . 51.2 mt -98.89 171.78 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.434 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 173.514 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.589 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 24.0 t70 -62.87 -139.08 0.0 OUTLIER 'General case' 0 C--O 1.185 -2.292 0 C-N-CA 125.183 1.393 . . . . 0.0 111.497 -177.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.687 ' HA ' ' O ' ' A' ' 89' ' ' TYR 0.271 1.0 OUTLIER -40.72 -20.54 0.01 OUTLIER 'General case' 0 N--CA 1.535 3.799 0 N-CA-C 117.018 2.229 . . . . 0.0 117.018 -173.192 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.74 HD12 HG21 ' A' ' 84' ' ' ILE . 66.1 mt -60.81 -57.98 10.37 Favored 'General case' 0 C--N 1.281 -2.39 0 C-N-CA 124.124 0.97 . . . . 0.0 109.645 171.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.527 ' HB2' ' O ' ' A' ' 84' ' ' ILE . 10.2 m-20 -97.86 -49.21 4.89 Favored 'General case' 0 CA--C 1.491 -1.295 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.06 -178.659 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . 0.687 ' O ' ' HA ' ' A' ' 86' ' ' GLU . 5.4 p90 -135.39 -165.87 1.75 Allowed 'General case' 0 C--O 1.16 -3.62 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 -175.214 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.555 ' O ' ' HA ' ' A' ' 32' ' ' LEU . 9.0 mt -147.05 149.75 15.4 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.316 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 169.261 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.531 HD21 ' CD1' ' A' ' 32' ' ' LEU . 37.2 mt -118.56 122.16 41.96 Favored 'General case' 0 N--CA 1.412 -2.34 0 O-C-N 124.453 1.096 . . . . 0.0 112.432 178.548 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.477 HD12 ' N ' ' A' ' 92' ' ' LEU . 1.7 mp -129.88 157.56 76.44 Favored Pre-proline 0 C--N 1.3 -1.546 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 -178.35 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -63.77 169.56 9.95 Favored 'Trans proline' 0 CA--C 1.5 -1.204 0 C-N-CA 122.442 2.095 . . . . 0.0 110.243 176.205 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 18.5 m -36.71 -56.4 0.84 Allowed 'General case' 0 C--N 1.322 -0.601 0 O-C-N 124.611 1.194 . . . . 0.0 110.738 170.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -59.2 -36.86 76.11 Favored 'General case' 0 C--O 1.199 -1.575 0 C-N-CA 124.812 1.245 . . . . 0.0 112.392 -174.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.596 ' O ' HD22 ' A' ' 100' ' ' LEU . . . -59.02 -62.74 5.88 Favored Glycine 0 N--CA 1.423 -2.23 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 179.363 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.453 ' HB2' ' HB2' ' A' ' 31' ' ' TYR . 68.8 t-105 -52.69 -49.79 64.6 Favored 'General case' 0 C--N 1.315 -0.893 0 C-N-CA 124.717 1.207 . . . . 0.0 110.488 177.686 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.481 ' O ' ' HB2' ' A' ' 102' ' ' SER . 34.4 t30 -53.49 -31.49 46.13 Favored 'General case' 0 N--CA 1.419 -2.014 0 C-N-CA 126.787 2.035 . . . . 0.0 111.962 178.339 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 52.7 mttm -78.22 -49.57 13.51 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-N 118.103 0.41 . . . . 0.0 110.402 174.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.596 HD22 ' O ' ' A' ' 96' ' ' GLY . 1.0 OUTLIER -57.4 -42.72 82.79 Favored 'General case' 0 C--O 1.24 0.567 0 CA-C-O 121.476 0.655 . . . . 0.0 111.362 -179.484 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 49.1 t -71.66 -27.99 29.79 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.809 0 C-N-CA 123.768 0.827 . . . . 0.0 111.091 177.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . 0.481 ' HB2' ' O ' ' A' ' 98' ' ' ASN . 22.7 t -71.23 -34.08 70.46 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 178.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' TRP . . . . . . . . . . . . . 41.1 m0 -83.96 -54.0 5.17 Favored 'General case' 0 N--CA 1.423 -1.811 0 CA-C-N 115.266 -0.879 . . . . 0.0 112.239 -175.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -127.51 10.72 6.73 Favored 'General case' 0 CA--C 1.502 -0.88 0 N-CA-C 114.359 1.244 . . . . 0.0 114.359 -173.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 24.8 p 56.64 172.0 0.04 OUTLIER 'General case' 0 N--CA 1.411 -2.385 0 N-CA-C 116.774 2.139 . . . . 0.0 116.774 178.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.07 153.37 17.68 Favored 'General case' 0 C--N 1.282 -2.337 0 N-CA-C 105.831 -1.914 . . . . 0.0 105.831 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.582 ' HG3' ' HB2' ' A' ' 66' ' ' ASP . 65.3 mmm -64.62 156.17 30.94 Favored 'General case' 0 CA--C 1.493 -1.225 0 CA-C-O 121.299 0.571 . . . . 0.0 110.348 173.418 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -74.78 149.03 39.86 Favored 'General case' 0 N--CA 1.407 -2.609 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.043 -179.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 83.47 -34.55 2.89 Favored Glycine 0 N--CA 1.423 -2.183 0 CA-C-N 115.251 -0.886 . . . . 0.0 112.109 -178.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -79.0 150.67 31.89 Favored 'General case' 0 N--CA 1.411 -2.395 0 CA-C-O 121.302 0.573 . . . . 0.0 111.116 179.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -133.01 146.42 61.19 Favored Pre-proline 0 N--CA 1.406 -2.646 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -48.63 128.39 18.17 Favored 'Trans proline' 0 CA--C 1.467 -2.825 0 C-N-CA 124.097 3.198 . . . . 0.0 114.544 -174.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.618 HG22 HD13 ' A' ' 32' ' ' LEU . 45.9 mt -85.21 107.47 16.08 Favored 'Isoleucine or valine' 1 N--CA 1.371 -4.384 0 CA-C-N 113.28 -1.782 . . . . 0.0 106.879 175.809 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.405 ' HB1' ' CG2' ' A' ' 29' ' ' THR . . . -103.86 135.64 45.03 Favored 'General case' 0 C--N 1.275 -2.656 0 CA-C-O 121.446 0.641 . . . . 0.0 110.823 -178.491 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.531 ' HB2' HD11 ' A' ' 32' ' ' LEU . 13.2 tpt180 -136.25 126.97 27.26 Favored 'General case' 0 CA--C 1.455 -2.697 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 179.151 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.84 -176.27 3.82 Favored 'General case' 0 C--N 1.253 -3.622 0 CA-C-O 123.358 1.552 . . . . 0.0 112.125 179.186 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.577 HG12 ' HB2' ' A' ' 24' ' ' LEU . 9.0 m -66.71 -172.11 0.06 OUTLIER 'Isoleucine or valine' 1 N--CA 1.371 -4.394 0 CA-C-N 111.249 -2.705 . . . . 0.0 111.77 172.69 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 26.9 m -67.67 133.07 32.14 Favored 'Isoleucine or valine' 0 N--CA 1.395 -3.196 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.909 176.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -118.78 13.04 13.14 Favored 'General case' 0 C--N 1.275 -2.649 0 CA-C-O 123.033 1.397 . . . . 0.0 107.682 178.117 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 . . . . . 0 N--CA 1.427 -1.603 0 CA-C-N 112.527 -2.124 . . . . 0.0 111.057 -179.3 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.5 ptm . . . . . 0 CA--C 1.503 -0.862 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -132.32 9.48 4.4 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-O 122.547 1.165 . . . . 0.0 108.535 175.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -151.77 155.32 37.99 Favored 'General case' 0 C--N 1.285 -2.208 0 CA-C-N 113.457 -1.701 . . . . 0.0 107.195 -178.456 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 105.41 -133.42 11.57 Favored Glycine 0 N--CA 1.427 -1.964 0 C-N-CA 120.056 -1.069 . . . . 0.0 112.487 177.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 74.43 43.75 29.7 Favored Glycine 0 CA--C 1.483 -1.957 0 N-CA-C 107.088 -2.405 . . . . 0.0 107.088 -173.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.613 ' HA ' ' CD1' ' A' ' 103' ' ' TRP . . . -90.39 143.18 26.99 Favored 'General case' 0 N--CA 1.406 -2.641 0 CA-C-N 113.416 -1.392 . . . . 0.0 114.294 -169.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.588 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . -74.26 156.4 37.25 Favored 'General case' 0 N--CA 1.422 -1.844 0 CA-C-N 113.128 -1.851 . . . . 0.0 109.322 176.469 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.601 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 23.3 t70 -69.02 151.35 46.6 Favored 'General case' 0 C--O 1.194 -1.847 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 174.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -41.05 -52.49 3.18 Favored 'General case' 0 C--N 1.307 -1.258 0 C-N-CA 126.263 1.825 . . . . 0.0 112.447 177.373 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -68.91 -31.02 69.62 Favored 'General case' 0 C--N 1.271 -2.808 0 CA-C-N 113.593 -1.639 . . . . 0.0 110.221 -175.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.588 ' CG2' ' HB1' ' A' ' 7' ' ' ALA . 16.5 m -73.65 -44.3 57.18 Favored 'General case' 1 N--CA 1.377 -4.098 0 CA-C-N 114.57 -1.196 . . . . 0.0 110.786 177.847 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.601 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 45.9 mt-30 -56.78 -57.27 13.17 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 122.651 0.38 . . . . 0.0 111.589 -173.512 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.501 ' HB3' HG13 ' A' ' 45' ' ' VAL . 0.0 OUTLIER -52.95 -41.37 64.44 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-O 121.151 0.501 . . . . 0.0 112.165 177.029 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.5 m -69.72 -47.16 64.09 Favored 'General case' 0 C--N 1.291 -1.965 0 CA-C-N 115.668 -0.697 . . . . 0.0 111.572 -178.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.575 ' O ' ' HB ' ' A' ' 18' ' ' THR . 13.5 t70 -61.31 -43.75 98.36 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 124.487 1.115 . . . . 0.0 110.64 -178.079 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.61 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 32.0 mm -72.88 -37.26 54.0 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.998 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.055 -178.375 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.405 ' O ' ' HG3' ' A' ' 21' ' ' LYS . . . -61.6 -36.99 82.27 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.575 ' HB ' ' O ' ' A' ' 15' ' ' ASP . 6.3 m -62.15 -33.99 75.55 Favored 'General case' 0 N--CA 1.408 -2.549 0 C-N-CA 125.898 1.679 . . . . 0.0 111.741 178.314 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 73.5 mt -85.79 -13.95 46.64 Favored 'General case' 0 C--N 1.27 -2.875 0 O-C-N 121.258 -0.901 . . . . 0.0 111.886 -177.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.61 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 14.3 mt -86.33 -26.88 24.64 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.611 0.72 . . . . 0.0 109.485 177.376 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.405 ' HG3' ' O ' ' A' ' 17' ' ' ALA . 0.1 OUTLIER -89.36 -7.66 54.81 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-O 122.35 1.071 . . . . 0.0 111.659 -174.507 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 15.2 m -75.73 136.71 40.32 Favored 'General case' 0 N--CA 1.386 -3.625 0 CA-C-N 113.207 -1.815 . . . . 0.0 110.729 176.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.5 m -75.03 142.86 43.75 Favored 'General case' 0 N--CA 1.403 -2.809 0 CA-C-N 113.724 -1.58 . . . . 0.0 111.549 178.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.534 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP . 0.5 OUTLIER -98.52 179.56 4.66 Favored 'General case' 0 N--CA 1.423 -1.812 0 N-CA-C 114.228 1.196 . . . . 0.0 114.228 -178.312 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.584 ' O ' HG21 ' A' ' 117' ' ' VAL . 3.6 mmp_? -127.23 -145.52 0.32 Allowed 'General case' 0 C--O 1.203 -1.383 0 C-N-CA 123.466 0.706 . . . . 0.0 110.894 -172.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -119.24 122.46 41.99 Favored 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 171.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 68.23 36.53 85.17 Favored Glycine 0 C--O 1.224 -0.493 0 N-CA-C 110.857 -0.897 . . . . 0.0 110.857 -177.086 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.455 ' HB2' ' HB2' ' A' ' 25' ' ' ARG . 34.1 t70 -79.23 -8.68 59.22 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-O 121.786 0.803 . . . . 0.0 111.989 -174.509 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.471 ' HA ' ' HA ' ' A' ' 116' ' ' LYS . 25.9 m 49.55 110.2 0.0 OUTLIER 'General case' 0 C--N 1.282 -2.344 0 C-N-CA 127.159 2.184 . . . . 0.0 114.369 -176.147 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.534 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 13.1 m95 -114.25 134.62 54.81 Favored 'General case' 0 C--N 1.3 -1.564 0 CA-C-N 114.693 -1.14 . . . . 0.0 109.172 -178.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -104.44 147.96 26.97 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 111.367 0.136 . . . . 0.0 111.367 -174.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.667 ' HA ' ' O ' ' A' ' 90' ' ' ILE . 5.8 mp -93.24 144.85 24.9 Favored 'General case' 0 CA--C 1.491 -1.307 0 N-CA-C 114.328 1.232 . . . . 0.0 114.328 -175.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 75.4 t -131.11 140.94 47.34 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.715 0 N-CA-C 105.871 -1.9 . . . . 0.0 105.871 173.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.493 ' HA ' HD11 ' A' ' 70' ' ' LEU . 20.1 t0 -64.62 131.61 47.47 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 173.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.44 ' O ' ' HE3' ' A' ' 39' ' ' LYS . 47.6 t -59.79 -37.54 79.39 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.262 -176.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 88.5 mtm180 -68.48 -34.31 75.71 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.848 -174.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.485 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 65.3 t90 -66.11 -46.37 77.84 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 177.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.532 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 32.7 t80 -64.7 -41.63 95.88 Favored 'General case' 0 C--O 1.206 -1.187 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.135 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.494 ' HG3' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.27 -38.98 69.28 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 118.394 0.543 . . . . 0.0 111.868 173.394 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.485 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 22.9 tp60 -65.58 -41.85 92.43 Favored 'General case' 0 N--CA 1.421 -1.906 0 CA-C-O 121.279 0.562 . . . . 0.0 109.854 175.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.4 ' HZ2' ' HB3' ' A' ' 12' ' ' GLN . 77.1 t90 -63.09 -39.68 95.43 Favored 'General case' 0 N--CA 1.437 -1.097 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.001 178.198 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.532 ' HG3' ' O ' ' A' ' 38' ' ' PHE . 35.8 mtmt -57.65 -40.08 78.48 Favored 'General case' 0 CA--C 1.515 -0.396 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 178.518 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -61.24 -48.63 80.57 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.884 0.849 . . . . 0.0 109.862 176.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.631 ' HB2' HG23 ' A' ' 60' ' ' VAL . 2.1 t80 -66.48 -41.92 88.22 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 113.548 -1.66 . . . . 0.0 112.709 -175.458 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.501 HG13 ' HB3' ' A' ' 13' ' ' ARG . 1.6 p -90.54 -15.99 8.37 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.05 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.789 -173.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.583 ' HA2' ' HB2' ' A' ' 52' ' ' LYS . . . 75.83 33.18 51.79 Favored Glycine 0 N--CA 1.416 -2.639 0 C-N-CA 121.249 -0.5 . . . . 0.0 112.119 -176.468 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.458 ' HB2' ' CG1' ' A' ' 45' ' ' VAL . 54.4 t80 -68.36 -45.48 72.68 Favored 'General case' 0 N--CA 1.44 -0.973 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.45 ' O ' ' HB3' ' A' ' 52' ' ' LYS . 70.2 m-20 -78.81 116.29 19.05 Favored 'General case' 0 CA--C 1.491 -1.29 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 178.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 36.0 m -66.63 -27.84 68.0 Favored 'General case' 0 C--N 1.291 -1.963 0 N-CA-C 111.8 0.296 . . . . 0.0 111.8 -178.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 45.0 p90 -82.57 -14.39 54.94 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.59 -178.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -154.53 101.06 2.31 Favored 'General case' 0 CA--C 1.488 -1.413 0 CA-C-O 121.417 0.627 . . . . 0.0 110.21 -179.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.583 ' HB2' ' HA2' ' A' ' 46' ' ' GLY . 22.8 pttp -156.91 21.41 0.32 Allowed 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 114.66 -1.154 . . . . 0.0 111.748 -171.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -70.79 -4.09 22.19 Favored 'General case' 0 C--N 1.266 -3.046 0 CA-C-N 114.503 -1.226 . . . . 0.0 110.177 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.436 ' HB3' HG11 ' A' ' 60' ' ' VAL . 0.2 OUTLIER -106.87 11.71 29.71 Favored 'General case' 0 N--CA 1.403 -2.779 0 C-N-CA 124.467 1.107 . . . . 0.0 109.167 -177.3 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . 0.589 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 50.0 ttm -60.98 103.56 0.28 Allowed 'General case' 0 N--CA 1.428 -1.555 0 C-N-CA 123.837 0.855 . . . . 0.0 110.914 179.56 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 89.54 15.69 58.04 Favored Glycine 0 N--CA 1.439 -1.117 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.873 -178.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.579 ' HB3' HG22 ' A' ' 60' ' ' VAL . 29.3 t0 -89.89 142.89 27.27 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 179.7 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -82.82 -16.25 48.48 Favored 'General case' 0 C--N 1.296 -1.72 0 CA-C-O 122.358 1.075 . . . . 0.0 109.061 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 66.3 m-20 -62.51 -26.3 68.47 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 114.317 -1.311 . . . . 0.0 111.171 175.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.631 HG23 ' HB2' ' A' ' 44' ' ' TYR . 27.3 m -123.33 1.95 5.78 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.693 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.113 -172.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -66.37 119.56 63.35 Favored Pre-proline 0 C--N 1.299 -1.594 0 C-N-CA 119.426 -0.91 . . . . 0.0 110.495 -178.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -87.22 117.07 1.25 Allowed 'Trans proline' 0 N--CA 1.413 -3.257 0 C-N-CA 122.529 2.153 . . . . 0.0 110.22 177.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -71.47 -145.35 0.41 Allowed Glycine 0 C--N 1.267 -3.26 0 CA-C-N 113.875 -1.511 . . . . 0.0 112.779 177.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -54.62 135.71 67.86 Favored 'Trans proline' 0 C--O 1.253 1.27 0 C-N-CA 123.001 2.468 . . . . 0.0 112.822 -177.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.568 HD11 ' HB3' ' A' ' 100' ' ' LEU . 57.2 mt -70.04 107.18 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.927 0 CA-C-N 115.133 -0.94 . . . . 0.0 112.029 -176.402 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -95.97 128.4 42.83 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.115 175.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.512 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 35.1 m-80 -124.21 11.82 8.83 Favored 'General case' 0 C--N 1.315 -0.933 0 O-C-N 123.96 0.787 . . . . 0.0 110.412 -179.006 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 23.0 t -59.95 -30.16 68.89 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -173.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -76.09 -13.28 83.37 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 121.479 -0.391 . . . . 0.0 112.547 -178.271 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.493 HD11 ' HA ' ' A' ' 34' ' ' ASP . 37.4 mt -91.08 -20.48 22.01 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 67' ' ' ASN . 44.9 mt -83.96 159.11 21.32 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.237 -170.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.455 ' HG3' ' C ' ' A' ' 79' ' ' LEU . 58.1 mtpt -87.46 -173.48 4.38 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-O 121.804 0.811 . . . . 0.0 111.797 178.636 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -95.8 109.6 21.89 Favored 'General case' 0 C--N 1.293 -1.86 0 CA-C-N 114.776 -1.102 . . . . 0.0 108.618 -175.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 124.88 -49.59 0.9 Allowed Glycine 0 N--CA 1.44 -1.07 0 C-N-CA 120.311 -0.947 . . . . 0.0 112.192 177.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -120.97 136.69 54.91 Favored 'General case' 0 CA--C 1.478 -1.808 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.476 ' HA ' HD13 ' A' ' 71' ' ' LEU . . . -89.82 4.75 48.84 Favored 'General case' 0 C--N 1.295 -1.761 0 CA-C-O 122.151 0.977 . . . . 0.0 109.509 178.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -112.68 2.85 16.29 Favored 'General case' 0 C--N 1.303 -1.44 0 CA-C-O 122.242 1.02 . . . . 0.0 108.506 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.2 t -113.56 140.68 47.96 Favored 'General case' 0 C--N 1.287 -2.12 0 N-CA-C 106.364 -1.717 . . . . 0.0 106.364 177.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.505 ' HA ' ' HA ' ' A' ' 71' ' ' LEU . 1.0 OUTLIER -126.41 153.84 44.44 Favored 'General case' 0 N--CA 1.409 -2.495 0 C-N-CA 120.719 -0.392 . . . . 0.0 110.391 -174.49 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.61 ' HB2' HD13 ' A' ' 83' ' ' LEU . 66.2 mttm -55.25 144.23 25.34 Favored 'General case' 0 C--N 1.31 -1.144 0 N-CA-C 116.055 1.872 . . . . 0.0 116.055 -171.683 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -48.02 -58.24 4.71 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 127.218 2.207 . . . . 0.0 115.847 -172.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 41.4 m80 -91.84 -1.76 57.19 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 113.882 1.067 . . . . 0.0 113.882 -169.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.61 HD13 ' HB2' ' A' ' 80' ' ' LYS . 10.7 mp -59.98 127.5 32.21 Favored 'General case' 0 C--O 1.254 1.303 0 N-CA-C 115.307 1.595 . . . . 0.0 115.307 -176.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.65 HG21 HD12 ' A' ' 87' ' ' LEU . 61.8 mt -97.74 174.01 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 CA-C-N 112.67 -2.059 . . . . 0.0 107.029 177.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.517 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 18.3 t70 -61.59 -139.98 0.0 OUTLIER 'General case' 0 CA--C 1.581 2.173 0 C-N-CA 126.071 1.749 . . . . 0.0 110.684 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.63 ' HA ' ' O ' ' A' ' 89' ' ' TYR 0.252 0.2 OUTLIER -40.33 -18.86 0.01 OUTLIER 'General case' 0 N--CA 1.517 2.875 0 C-N-CA 127.333 2.253 . . . . 0.0 116.65 -171.811 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.65 HD12 HG21 ' A' ' 84' ' ' ILE . 54.7 mt -65.18 -59.15 4.41 Favored 'General case' 0 C--N 1.274 -2.678 0 C-N-CA 124.638 1.175 . . . . 0.0 110.847 172.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.417 ' HB3' ' HG ' ' A' ' 83' ' ' LEU . 36.4 m-20 -97.12 -39.18 9.43 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.709 -175.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . 0.63 ' O ' ' HA ' ' A' ' 86' ' ' GLU . 2.6 p90 -145.05 -164.34 1.91 Allowed 'General case' 0 C--O 1.162 -3.511 0 N-CA-C 105.172 -2.158 . . . . 0.0 105.172 -177.344 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.667 ' O ' ' HA ' ' A' ' 32' ' ' LEU . 3.1 mt -144.85 150.94 15.72 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.313 0 CA-C-N 120.25 1.386 . . . . 0.0 108.767 171.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.545 HD21 ' CD1' ' A' ' 32' ' ' LEU . 26.4 mt -119.98 117.98 29.47 Favored 'General case' 0 N--CA 1.393 -3.286 0 O-C-N 124.444 1.09 . . . . 0.0 110.936 175.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.513 ' HB3' ' HA3' ' A' ' 96' ' ' GLY . 1.2 mm? -111.95 161.14 27.15 Favored Pre-proline 0 CA--C 1.487 -1.48 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 177.334 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -59.78 168.22 5.87 Favored 'Trans proline' 0 C--O 1.257 1.432 0 C-N-CA 121.886 1.724 . . . . 0.0 108.158 165.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 34.1 m -50.89 -40.48 56.79 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 177.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.463 ' O ' ' HG2' ' A' ' 99' ' ' LYS . 6.3 mm-40 -57.12 -52.71 64.19 Favored 'General case' 0 C--O 1.198 -1.635 0 C-N-CA 124.021 0.929 . . . . 0.0 111.522 177.048 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.544 ' O ' HD22 ' A' ' 100' ' ' LEU . . . -54.23 -57.61 16.2 Favored Glycine 0 CA--C 1.495 -1.211 0 O-C-N 124.049 0.843 . . . . 0.0 112.082 -175.033 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 47.8 t-105 -53.66 -51.02 64.49 Favored 'General case' 0 C--N 1.289 -2.027 0 C-N-CA 123.512 0.725 . . . . 0.0 111.287 174.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -55.03 -28.79 54.9 Favored 'General case' 0 C--O 1.195 -1.782 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 175.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.644 ' HB3' ' CH2' ' A' ' 103' ' ' TRP . 19.0 mmtp -69.76 -57.14 5.47 Favored 'General case' 0 N--CA 1.41 -2.465 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 177.257 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.568 ' HB3' HD11 ' A' ' 65' ' ' ILE . 0.5 OUTLIER -58.88 -39.22 80.74 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.918 -176.94 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.523 ' O ' ' HA ' ' A' ' 105' ' ' THR . 55.2 t -75.6 -26.71 18.36 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.377 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.817 177.268 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 25.9 t -73.73 -39.08 64.53 Favored 'General case' 0 C--N 1.296 -1.725 0 O-C-N 120.96 -1.087 . . . . 0.0 108.583 176.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' TRP . . . . . 0.644 ' CH2' ' HB3' ' A' ' 99' ' ' LYS . 26.1 m0 -79.35 -49.51 12.29 Favored 'General case' 0 N--CA 1.437 -1.097 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.954 -174.369 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 64.5 m-85 -126.84 8.62 6.85 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 114.108 1.151 . . . . 0.0 114.108 -176.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.523 ' HA ' ' O ' ' A' ' 101' ' ' VAL 0.268 6.0 t 49.63 -174.58 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 126.608 1.963 . . . . 0.0 115.584 179.538 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -98.34 157.43 16.19 Favored 'General case' 0 C--N 1.247 -3.862 0 CA-C-N 112.733 -2.031 . . . . 0.0 107.45 -174.421 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 23.2 tpp -74.57 137.96 42.73 Favored 'General case' 1 N--CA 1.369 -4.475 0 CA-C-O 121.749 0.785 . . . . 0.0 109.311 175.372 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -63.35 123.49 18.83 Favored 'General case' 1 N--CA 1.362 -4.844 0 C-N-CA 126.188 1.795 . . . . 0.0 110.583 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 107.97 -15.25 37.12 Favored Glycine 0 N--CA 1.421 -2.31 0 CA-C-N 113.809 -1.541 . . . . 0.0 111.039 -177.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -104.02 156.74 17.61 Favored 'General case' 0 N--CA 1.434 -1.23 0 CA-C-O 121.885 0.85 . . . . 0.0 112.426 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -134.72 141.31 38.18 Favored Pre-proline 0 C--N 1.292 -1.919 0 N-CA-C 106.119 -1.808 . . . . 0.0 106.119 -177.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -48.73 125.34 12.57 Favored 'Trans proline' 0 CA--C 1.47 -2.684 0 C-N-CA 123.962 3.108 . . . . 0.0 115.263 -172.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.49 HG12 HD21 ' A' ' 71' ' ' LEU . 3.7 mp -90.73 109.22 20.64 Favored 'Isoleucine or valine' 1 N--CA 1.377 -4.092 0 CA-C-N 112.411 -2.177 . . . . 0.0 106.011 177.43 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -108.69 138.74 44.53 Favored 'General case' 0 C--N 1.281 -2.387 0 CA-C-O 121.927 0.87 . . . . 0.0 112.397 -177.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.563 ' HG3' HD11 ' A' ' 32' ' ' LEU . 11.8 mmm180 -120.57 -172.12 2.31 Favored 'General case' 0 C--N 1.282 -2.346 0 N-CA-C 104.126 -2.546 . . . . 0.0 104.126 173.031 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.471 ' HA ' ' HA ' ' A' ' 29' ' ' THR . 24.4 pttm -135.48 -167.31 1.99 Allowed 'General case' 0 C--N 1.247 -3.871 0 N-CA-C 107.353 -1.351 . . . . 0.0 107.353 176.167 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.584 HG21 ' O ' ' A' ' 25' ' ' ARG . 59.4 t -60.26 134.22 25.59 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.291 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 171.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . 0.401 HG22 ' H ' ' A' ' 118' ' ' VAL . 19.2 m -73.6 -178.82 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.271 -2.813 0 N-CA-C 115.568 1.692 . . . . 0.0 115.568 -166.595 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -57.85 -44.04 86.29 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-N 114.015 -1.448 . . . . 0.0 111.431 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 19.7 pt20 . . . . . 0 C--O 1.248 1.021 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.712 -176.552 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.2 mtt . . . . . 0 CA--C 1.503 -0.842 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -143.71 98.15 3.19 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 176.194 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -93.88 114.56 26.81 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 -179.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -78.39 74.99 2.0 Favored Glycine 0 C--N 1.309 -0.945 0 CA-C-N 116.251 -0.431 . . . . 0.0 112.687 -177.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -144.04 57.27 0.54 Allowed Glycine 0 CA--C 1.488 -1.653 0 N-CA-C 110.707 -0.957 . . . . 0.0 110.707 178.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.59 ' HA ' ' CD1' ' A' ' 103' ' ' TRP . . . -106.31 144.78 32.51 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-O 121.596 0.712 . . . . 0.0 111.868 -178.133 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.509 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . -68.77 172.93 5.72 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 113.879 -1.51 . . . . 0.0 111.307 178.584 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.51 ' O ' ' HB ' ' A' ' 11' ' ' THR . 21.2 t70 -74.7 149.25 39.95 Favored 'General case' 0 C--O 1.199 -1.57 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.378 178.246 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.41 ' HA ' ' HG3' ' A' ' 12' ' ' GLN . 18.7 mt -51.43 -38.53 54.08 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.635 0.774 . . . . 0.0 111.2 -177.47 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -67.51 -38.65 84.59 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-N 113.684 -1.598 . . . . 0.0 109.227 -176.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.51 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 8.2 m -74.05 -48.3 30.83 Favored 'General case' 0 N--CA 1.38 -3.929 0 CA-C-N 113.604 -1.634 . . . . 0.0 110.597 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.457 ' HB3' ' HZ2' ' A' ' 41' ' ' TRP . 14.5 mt-30 -52.51 -54.29 34.52 Favored 'General case' 0 CA--C 1.48 -1.721 0 O-C-N 123.903 0.752 . . . . 0.0 110.561 -174.688 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.664 ' HD3' HG21 ' A' ' 45' ' ' VAL . 4.0 mmm180 -70.6 -32.32 69.62 Favored 'General case' 0 CA--C 1.452 -2.797 0 N-CA-C 115.627 1.714 . . . . 0.0 115.627 -176.081 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 33.8 t -72.02 -45.54 60.5 Favored 'General case' 0 C--N 1.273 -2.72 0 O-C-N 123.971 0.794 . . . . 0.0 110.063 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -70.45 -31.41 68.57 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.927 -175.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.543 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 3.7 mm -80.88 -42.97 20.71 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.714 0 CA-C-N 115.297 -0.865 . . . . 0.0 112.222 176.606 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.531 ' O ' ' HG2' ' A' ' 21' ' ' LYS . . . -55.47 -37.29 67.6 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.484 ' HA ' ' HD3' ' A' ' 21' ' ' LYS . 1.2 m -63.1 -34.55 77.83 Favored 'General case' 0 N--CA 1.405 -2.718 0 CA-C-N 113.75 -1.568 . . . . 0.0 112.276 -179.284 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.419 HD11 ' HE3' ' A' ' 99' ' ' LYS . 82.9 mt -86.09 -14.03 45.48 Favored 'General case' 0 C--N 1.275 -2.643 0 O-C-N 121.694 -0.629 . . . . 0.0 112.305 -176.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 20.4 mt -84.11 -28.24 27.63 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 178.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.531 ' HG2' ' O ' ' A' ' 17' ' ' ALA . 19.2 ptmt -88.47 -23.35 23.27 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 114.705 -1.134 . . . . 0.0 110.945 -175.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.2 m -57.4 141.55 46.89 Favored 'General case' 0 N--CA 1.404 -2.761 0 C-N-CA 125.24 1.416 . . . . 0.0 111.233 173.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.3 m -87.33 170.11 11.69 Favored 'General case' 0 N--CA 1.403 -2.777 0 CA-C-N 114.027 -1.442 . . . . 0.0 111.969 -176.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.639 ' HB2' HG12 ' A' ' 117' ' ' VAL . 0.7 OUTLIER -112.78 163.91 14.02 Favored 'General case' 0 N--CA 1.408 -2.569 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 178.003 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 28.3 mmt180 -104.59 -159.55 0.72 Allowed 'General case' 0 C--N 1.297 -1.675 0 CA-C-N 114.514 -1.221 . . . . 0.0 108.186 176.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -109.64 18.72 19.98 Favored 'General case' 0 N--CA 1.42 -1.963 0 N-CA-C 106.808 -1.552 . . . . 0.0 106.808 175.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.485 ' N ' HG21 ' A' ' 117' ' ' VAL . . . -155.85 29.65 0.6 Allowed Glycine 0 N--CA 1.427 -1.959 0 CA-C-N 114.284 -1.326 . . . . 0.0 112.915 179.182 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.46 ' HB2' ' CG1' ' A' ' 117' ' ' VAL . 57.2 m-20 -95.69 153.36 17.77 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 119.189 -1.004 . . . . 0.0 109.6 176.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 98.9 m -104.99 129.21 53.48 Favored 'General case' 0 C--N 1.287 -2.122 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 174.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.532 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 40.9 m95 -116.51 139.11 50.83 Favored 'General case' 0 C--N 1.297 -1.696 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -178.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.436 ' HB2' ' HB2' ' A' ' 97' ' ' TRP . 72.3 m-85 -104.92 141.78 35.94 Favored 'General case' 0 C--N 1.276 -2.63 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.305 -176.013 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.504 HD11 ' HB2' ' A' ' 115' ' ' ARG . 6.0 mp -89.65 136.87 32.78 Favored 'General case' 0 CA--C 1.49 -1.344 0 O-C-N 124.383 1.052 . . . . 0.0 111.513 179.67 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.449 HG12 ' O ' ' A' ' 34' ' ' ASP . 81.7 t -121.74 140.36 45.98 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.868 0 N-CA-C 104.41 -2.441 . . . . 0.0 104.41 172.339 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.481 ' OD2' ' HB2' ' A' ' 36' ' ' ARG . 5.5 p-10 -69.69 127.38 32.76 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 106.153 -1.795 . . . . 0.0 106.153 172.157 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 69.6 p -67.37 -19.19 65.39 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-O 121.565 0.698 . . . . 0.0 110.899 -172.407 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.481 ' HB2' ' OD2' ' A' ' 34' ' ' ASP . 44.5 mtt180 -63.9 -48.06 78.14 Favored 'General case' 0 C--N 1.285 -2.235 0 C-N-CA 125.51 1.524 . . . . 0.0 108.29 -177.023 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.464 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 73.6 t90 -63.84 -48.09 78.18 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 124.597 1.159 . . . . 0.0 108.803 177.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.423 ' CG ' HD12 ' A' ' 90' ' ' ILE . 23.3 t80 -61.86 -40.04 93.95 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 114.858 -1.064 . . . . 0.0 111.614 -177.631 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -67.02 -34.36 77.56 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 175.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.464 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 23.8 tp60 -65.55 -42.39 91.94 Favored 'General case' 0 N--CA 1.423 -1.796 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 175.068 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.647 ' O ' HG22 ' A' ' 45' ' ' VAL . 47.8 t90 -66.04 -37.81 86.79 Favored 'General case' 0 N--CA 1.436 -1.14 0 CA-C-N 114.256 -1.338 . . . . 0.0 110.036 179.805 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.0 mtpp -53.72 -45.52 70.5 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.746 0.818 . . . . 0.0 113.177 175.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.47 ' HG2' ' OD2' ' A' ' 51' ' ' ASP . 51.5 mttm -65.31 -46.25 81.07 Favored 'General case' 0 CA--C 1.507 -0.676 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 177.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.453 ' HB2' HG23 ' A' ' 60' ' ' VAL . 3.5 t80 -55.29 -33.09 62.93 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 114.306 -1.315 . . . . 0.0 113.539 -179.448 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.664 HG21 ' HD3' ' A' ' 13' ' ' ARG . 5.7 m -102.45 -11.75 8.92 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -179.392 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.456 ' HA2' ' HB2' ' A' ' 52' ' ' LYS . . . 71.71 43.41 51.56 Favored Glycine 0 N--CA 1.415 -2.707 0 C-N-CA 120.003 -1.094 . . . . 0.0 111.554 -175.445 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -66.77 -45.1 79.57 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 176.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -83.44 153.87 24.25 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 115.225 -0.898 . . . . 0.0 108.958 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 5.4 p -84.51 -48.8 9.22 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-O 121.227 0.536 . . . . 0.0 111.921 -179.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 46.6 p90 -73.67 -16.6 61.21 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.752 -177.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.47 ' OD2' ' HG2' ' A' ' 43' ' ' LYS . 30.7 t70 -135.37 87.34 2.32 Favored 'General case' 0 CA--C 1.474 -1.954 0 CA-C-O 121.956 0.884 . . . . 0.0 111.159 -174.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.456 ' HB2' ' HA2' ' A' ' 46' ' ' GLY . 64.7 pttt -157.5 15.47 0.25 Allowed 'General case' 0 N--CA 1.429 -1.483 0 CA-C-N 113.835 -1.53 . . . . 0.0 112.236 -176.305 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 87.5 m-85 -64.1 -10.0 19.82 Favored 'General case' 0 C--N 1.292 -1.927 0 CA-C-N 114.922 -1.036 . . . . 0.0 110.356 173.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.59 ' HB3' HG11 ' A' ' 60' ' ' VAL . 11.0 mm100 -100.72 3.23 42.12 Favored 'General case' 0 N--CA 1.405 -2.724 0 C-N-CA 125.396 1.478 . . . . 0.0 110.753 -176.647 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . 0.404 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 48.7 ttp -65.09 109.13 2.05 Favored 'General case' 0 N--CA 1.426 -1.631 0 CA-C-O 121.227 0.537 . . . . 0.0 111.818 -176.311 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 89.95 2.36 75.04 Favored Glycine 0 N--CA 1.429 -1.777 0 CA-C-N 114.357 -1.292 . . . . 0.0 111.756 -178.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.501 ' HB3' HG22 ' A' ' 60' ' ' VAL . 4.8 t70 -77.28 152.27 34.68 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 -177.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.45 ' O ' ' HD2' ' A' ' 61' ' ' TYR . 20.7 pt20 -84.15 -24.32 30.27 Favored 'General case' 0 C--N 1.292 -1.895 0 CA-C-O 121.609 0.719 . . . . 0.0 109.809 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -61.13 -21.1 63.42 Favored 'General case' 0 CA--C 1.498 -1.039 0 CA-C-N 115.351 -0.84 . . . . 0.0 112.015 -179.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.59 HG11 ' HB3' ' A' ' 54' ' ' GLN . 28.8 m -119.47 2.39 7.18 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.073 0 CA-C-N 115.19 -0.914 . . . . 0.0 112.359 -173.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.45 ' HD2' ' O ' ' A' ' 58' ' ' GLN . 0.9 OUTLIER -65.3 114.63 16.19 Favored Pre-proline 0 C--N 1.314 -0.978 0 O-C-N 124.121 0.888 . . . . 0.0 110.504 -177.552 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -89.86 113.33 0.53 Allowed 'Trans proline' 0 N--CA 1.419 -2.871 0 C-N-CA 122.491 2.128 . . . . 0.0 109.688 177.052 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -70.64 -140.05 0.18 Allowed Glycine 0 C--N 1.281 -2.514 0 CA-C-N 114.923 -1.035 . . . . 0.0 113.163 177.094 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.402 ' HA ' ' O ' ' A' ' 104' ' ' TYR . 11.8 Cg_endo -56.16 145.24 77.28 Favored 'Trans proline' 0 C--O 1.252 1.205 0 C-N-CA 122.67 2.247 . . . . 0.0 112.739 -178.2 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 60.9 mt -72.63 117.09 15.67 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.98 -178.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.597 ' HB2' ' HG3' ' A' ' 107' ' ' MET . 17.0 t0 -116.33 104.53 11.57 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-O 121.896 0.855 . . . . 0.0 111.384 178.389 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.664 ' O ' HD23 ' A' ' 71' ' ' LEU . 42.9 m-80 -92.91 5.86 49.86 Favored 'General case' 0 C--N 1.284 -2.245 0 CA-C-N 114.899 -1.046 . . . . 0.0 111.04 -178.621 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 19.2 t -72.74 83.89 1.18 Allowed 'General case' 0 N--CA 1.445 -0.676 0 CA-C-O 122.523 1.154 . . . . 0.0 107.899 177.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 169.25 -20.74 0.08 OUTLIER Glycine 0 N--CA 1.42 -2.414 0 N-CA-C 108.45 -1.86 . . . . 0.0 108.45 -175.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.427 HD22 ' HB3' ' A' ' 89' ' ' TYR . 79.2 mt -88.41 -29.53 20.16 Favored 'General case' 0 CA--C 1.484 -1.568 0 N-CA-C 104.667 -2.345 . . . . 0.0 104.667 171.532 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.664 HD23 ' O ' ' A' ' 67' ' ' ASN . 2.2 mm? -75.88 156.79 33.99 Favored 'General case' 0 N--CA 1.38 -3.959 0 CA-C-N 110.781 -2.918 . . . . 0.0 107.084 173.114 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.457 ' HG3' ' O ' ' A' ' 78' ' ' SER . 38.0 mtpt -64.22 -176.95 0.24 Allowed 'General case' 0 C--N 1.292 -1.892 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 -174.621 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -62.82 -23.73 67.41 Favored 'General case' 0 CA--C 1.487 -1.444 0 N-CA-C 114.343 1.238 . . . . 0.0 114.343 -169.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -149.73 39.66 0.89 Allowed Glycine 0 N--CA 1.404 -3.464 0 C-N-CA 119.192 -1.48 . . . . 0.0 111.575 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -142.23 151.99 42.65 Favored 'General case' 0 CA--C 1.484 -1.558 0 CA-C-N 115.682 -0.259 . . . . 0.0 110.427 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -119.23 -1.86 10.77 Favored 'General case' 0 C--N 1.3 -1.554 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.71 177.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.605 ' HA ' HE21 ' A' ' 77' ' ' GLN . 0.0 OUTLIER -116.9 -14.17 10.67 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-O 121.732 0.777 . . . . 0.0 110.175 179.927 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.457 ' O ' ' HG3' ' A' ' 72' ' ' LYS . 20.2 m -108.15 119.71 40.27 Favored 'General case' 0 C--N 1.299 -1.629 0 CA-C-N 114.81 -1.086 . . . . 0.0 110.845 -175.276 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.575 HD11 HG21 ' A' ' 113' ' ' ILE . 3.0 mm? -81.58 148.8 28.93 Favored 'General case' 0 N--CA 1.437 -1.087 0 C-N-CA 123.914 0.886 . . . . 0.0 111.986 -179.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -63.68 151.9 40.59 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.557 176.452 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -75.1 -35.83 61.72 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-O 122.145 0.974 . . . . 0.0 108.653 -178.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 15.4 t-80 -88.07 12.8 12.58 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-N 114.486 -1.234 . . . . 0.0 112.795 -170.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.434 ' HB3' ' CE2' ' A' ' 89' ' ' TYR . 43.2 mt -57.23 141.63 45.88 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 114.263 1.208 . . . . 0.0 114.263 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.808 HG21 HD12 ' A' ' 87' ' ' LEU . 62.8 mt -137.14 166.49 25.37 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 N-CA-C 106.251 -1.759 . . . . 0.0 106.251 -178.519 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.579 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 17.7 t70 -62.55 -146.22 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.213 0 C-N-CA 125.582 1.553 . . . . 0.0 110.586 -178.097 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.712 ' HA ' ' O ' ' A' ' 89' ' ' TYR 0.271 0.0 OUTLIER -40.74 -18.19 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.662 0 N-CA-C 117.014 2.228 . . . . 0.0 117.014 -174.029 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.808 HD12 HG21 ' A' ' 84' ' ' ILE . 44.4 mt -61.02 -61.03 2.87 Favored 'General case' 0 C--N 1.281 -2.411 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.838 170.113 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -97.83 -41.19 8.16 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 -176.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . 0.712 ' O ' ' HA ' ' A' ' 86' ' ' GLU . 1.3 p90 -139.9 -169.15 2.66 Favored 'General case' 0 C--O 1.155 -3.892 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.571 -174.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.474 ' O ' ' HA ' ' A' ' 32' ' ' LEU . 10.3 mt -146.21 153.01 13.41 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.343 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 170.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.405 ' N ' HG22 ' A' ' 90' ' ' ILE . 81.7 mt -117.73 134.69 54.65 Favored 'General case' 0 N--CA 1.413 -2.302 0 O-C-N 124.2 0.938 . . . . 0.0 110.907 177.14 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.435 HD12 ' N ' ' A' ' 92' ' ' LEU . 1.8 mp -140.2 159.53 63.53 Favored Pre-proline 0 C--N 1.291 -1.971 0 N-CA-C 106.794 -1.558 . . . . 0.0 106.794 -177.516 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -63.46 168.75 10.8 Favored 'Trans proline' 0 C--O 1.256 1.389 0 C-N-CA 121.992 1.795 . . . . 0.0 110.251 175.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.435 ' HA ' ' CE1' ' A' ' 31' ' ' TYR . 33.0 m -42.8 -47.95 5.59 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 124.532 1.145 . . . . 0.0 110.799 172.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -66.21 -38.15 87.26 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-N 114.613 -1.176 . . . . 0.0 112.33 -175.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.471 ' O ' ' HG ' ' A' ' 100' ' ' LEU . . . -62.18 -51.3 57.64 Favored Glycine 0 N--CA 1.429 -1.815 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 -179.278 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.436 ' HB2' ' HB2' ' A' ' 31' ' ' TYR . 69.1 t-105 -57.54 -50.04 74.38 Favored 'General case' 0 N--CA 1.428 -1.566 0 CA-C-N 114.594 -0.803 . . . . 0.0 110.35 174.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -48.26 -45.22 34.28 Favored 'General case' 0 CA--C 1.489 -1.368 0 O-C-N 123.788 0.68 . . . . 0.0 111.621 176.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.419 ' HE3' HD11 ' A' ' 19' ' ' LEU . 60.5 mttm -66.4 -45.27 80.55 Favored 'General case' 0 N--CA 1.426 -1.639 0 CA-C-O 120.639 0.257 . . . . 0.0 110.625 -177.213 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 96' ' ' GLY . 64.9 mt -65.1 -34.23 77.92 Favored 'General case' 0 C--N 1.292 -1.934 0 CA-C-O 121.403 0.62 . . . . 0.0 111.289 -178.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.51 ' HA ' ' HA ' ' A' ' 105' ' ' THR . 8.8 t -78.84 -23.8 13.0 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.456 0 CA-C-O 121.771 0.796 . . . . 0.0 111.12 176.594 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 67.1 m -73.51 -37.98 65.5 Favored 'General case' 0 N--CA 1.418 -2.031 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 174.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' TRP . . . . . 0.59 ' CD1' ' HA ' ' A' ' 6' ' ' ALA . 44.8 m0 -84.34 -42.44 15.75 Favored 'General case' 0 N--CA 1.424 -1.758 0 CA-C-N 114.995 -1.002 . . . . 0.0 112.959 -174.28 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' TYR . . . . . 0.402 ' O ' ' HA ' ' A' ' 64' ' ' PRO . 73.1 m-85 -127.63 -5.28 5.84 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 111.817 0.303 . . . . 0.0 111.817 -174.418 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.51 ' HA ' ' HA ' ' A' ' 101' ' ' VAL 0.288 13.7 t 50.62 -174.11 0.02 OUTLIER 'General case' 0 C--O 1.247 0.927 0 C-N-CA 125.788 1.635 . . . . 0.0 113.979 -173.69 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.425 ' HG ' ' N ' ' A' ' 107' ' ' MET . 37.1 tp -107.13 149.85 27.21 Favored 'General case' 0 C--N 1.244 -3.996 0 CA-C-N 113.305 -1.77 . . . . 0.0 109.057 -177.419 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.597 ' HG3' ' HB2' ' A' ' 66' ' ' ASP . 80.3 mmm -59.38 154.37 16.99 Favored 'General case' 0 CA--C 1.492 -1.267 0 CA-C-O 122.131 0.967 . . . . 0.0 111.039 173.236 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -76.57 140.31 41.02 Favored 'General case' 0 N--CA 1.396 -3.165 0 CA-C-N 114.468 -1.242 . . . . 0.0 111.322 -176.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 88.84 -25.9 9.15 Favored Glycine 0 N--CA 1.412 -2.904 0 CA-C-N 114.743 -1.117 . . . . 0.0 113.667 175.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -92.01 172.19 8.61 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 119.681 -0.808 . . . . 0.0 109.355 -177.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -121.67 158.33 54.46 Favored Pre-proline 0 N--CA 1.432 -1.352 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -177.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . 0.409 ' HB3' ' CE2' ' A' ' 97' ' ' TRP . 22.9 Cg_exo -67.79 122.39 9.54 Favored 'Trans proline' 0 CA--C 1.448 -3.792 0 C-N-CA 122.358 2.039 . . . . 0.0 109.174 169.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.575 HG21 HD11 ' A' ' 79' ' ' LEU . 3.3 mp -82.79 109.33 16.55 Favored 'Isoleucine or valine' 1 N--CA 1.375 -4.208 0 CA-C-N 114.322 -1.308 . . . . 0.0 108.057 -178.637 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -102.13 137.98 39.69 Favored 'General case' 0 C--N 1.277 -2.574 0 CA-C-N 115.472 -0.786 . . . . 0.0 109.975 179.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.504 ' HB2' HD11 ' A' ' 32' ' ' LEU . 5.7 tpt180 -135.34 -178.71 5.23 Favored 'General case' 0 N--CA 1.402 -2.857 0 N-CA-C 103.841 -2.651 . . . . 0.0 103.841 178.269 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -137.03 179.27 6.48 Favored 'General case' 0 N--CA 1.402 -2.87 0 C-N-CA 118.217 -1.393 . . . . 0.0 113.27 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.639 HG12 ' HB2' ' A' ' 24' ' ' LEU . 7.3 m -60.4 -176.85 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.383 -3.793 0 CA-C-N 111.408 -2.633 . . . . 0.0 112.915 174.083 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 30.8 m -71.87 146.04 11.76 Favored 'Isoleucine or valine' 0 N--CA 1.386 -3.657 0 CA-C-N 114.894 -1.048 . . . . 0.0 109.783 175.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.402 ' H ' ' HG2' ' A' ' 119' ' ' GLU . 12.5 pt-20 -102.47 7.71 40.2 Favored 'General case' 0 C--N 1.273 -2.759 0 CA-C-N 114.258 -1.337 . . . . 0.0 109.409 -176.615 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.412 -2.332 0 CA-C-N 114.347 -1.297 . . . . 0.0 109.151 -178.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mpt? . . . . . 0 CA--C 1.501 -0.927 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -135.38 152.37 51.36 Favored 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 58.88 85.84 0.09 Allowed 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -101.51 60.56 0.59 Allowed Glycine 0 N--CA 1.434 -1.476 0 N-CA-C 109.358 -1.497 . . . . 0.0 109.358 175.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -80.78 88.07 1.34 Allowed Glycine 0 CA--C 1.485 -1.792 0 N-CA-C 110.694 -0.962 . . . . 0.0 110.694 -177.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.672 ' HA ' ' CD1' ' A' ' 103' ' ' TRP . . . -97.1 143.84 27.53 Favored 'General case' 0 N--CA 1.422 -1.874 0 CA-C-O 121.205 0.526 . . . . 0.0 112.416 -177.117 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.472 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . -72.74 175.9 6.04 Favored 'General case' 0 CA--C 1.502 -0.887 0 CA-C-N 114.281 -1.327 . . . . 0.0 109.613 175.153 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.682 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 13.8 t70 -69.14 145.46 53.32 Favored 'General case' 0 CA--C 1.467 -2.213 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 177.611 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -40.75 -51.53 3.07 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 126.083 1.753 . . . . 0.0 112.579 178.043 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -76.07 -31.55 58.83 Favored 'General case' 0 C--N 1.276 -2.587 0 CA-C-N 113.638 -1.619 . . . . 0.0 110.771 -176.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.502 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 3.7 m -65.14 -46.29 81.54 Favored 'General case' 0 N--CA 1.4 -2.94 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 177.271 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.682 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 53.7 mt-30 -54.66 -44.14 73.0 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-N 114.848 -1.069 . . . . 0.0 109.413 -179.081 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.474 ' CG ' ' HB ' ' A' ' 45' ' ' VAL . 3.2 mmp_? -70.32 -41.4 73.32 Favored 'General case' 0 N--CA 1.411 -2.387 0 N-CA-C 113.412 0.894 . . . . 0.0 113.412 -178.472 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.2 m -64.36 -46.3 84.02 Favored 'General case' 0 C--N 1.251 -3.683 0 CA-C-O 121.414 0.626 . . . . 0.0 110.484 -178.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.477 ' O ' ' HB ' ' A' ' 18' ' ' THR . 51.3 t0 -67.72 -46.83 71.07 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 114.659 -1.155 . . . . 0.0 109.671 -177.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.662 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 21.6 mm -71.94 -39.39 66.82 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.58 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.993 -177.449 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.487 ' O ' ' HG2' ' A' ' 21' ' ' LYS . . . -58.61 -34.8 71.54 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 -179.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.522 ' HA ' ' HE2' ' A' ' 21' ' ' LYS . 2.9 m -66.94 -42.07 85.92 Favored 'General case' 0 N--CA 1.4 -2.943 0 CA-C-N 113.975 -1.466 . . . . 0.0 111.905 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.456 HD11 ' HE3' ' A' ' 99' ' ' LYS . 82.0 mt -78.77 -12.67 60.03 Favored 'General case' 0 C--N 1.268 -2.962 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -175.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.662 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 20.6 mt -82.17 -31.48 30.42 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.098 -0.705 . . . . 0.0 109.098 176.264 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.522 ' HE2' ' HA ' ' A' ' 18' ' ' THR . 48.2 pttt -92.69 -25.93 18.02 Favored 'General case' 0 N--CA 1.425 -1.723 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.439 -174.101 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 31.8 m -67.73 137.67 55.66 Favored 'General case' 0 N--CA 1.398 -3.045 0 CA-C-O 122.336 1.065 . . . . 0.0 112.089 177.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.456 ' HA ' HD13 ' A' ' 24' ' ' LEU . 36.8 t -94.77 167.68 11.29 Favored 'General case' 0 N--CA 1.391 -3.421 0 CA-C-N 112.928 -1.942 . . . . 0.0 109.306 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.514 ' N ' HD13 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -105.19 177.95 4.7 Favored 'General case' 1 N--CA 1.377 -4.101 0 CA-C-N 112.834 -1.985 . . . . 0.0 114.301 -167.267 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.64 ' O ' HG21 ' A' ' 117' ' ' VAL . 25.1 mmt180 -134.13 143.24 47.83 Favored 'General case' 0 C--N 1.285 -2.215 0 CA-C-N 112.643 -2.071 . . . . 0.0 106.834 175.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 44.0 mtpt -67.9 95.19 0.51 Allowed 'General case' 0 C--N 1.306 -1.319 0 CA-C-O 121.808 0.813 . . . . 0.0 109.596 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 143.37 19.52 0.22 Allowed Glycine 0 N--CA 1.426 -1.971 0 CA-C-N 114.17 -1.377 . . . . 0.0 110.554 -174.355 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.403 ' HB2' ' CG2' ' A' ' 117' ' ' VAL . 37.1 m-20 -103.58 -179.63 4.0 Favored 'General case' 0 CA--C 1.499 -1.008 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 176.402 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 86.1 m -140.97 127.3 19.79 Favored 'General case' 0 N--CA 1.42 -1.958 0 N-CA-C 106.576 -1.638 . . . . 0.0 106.576 176.015 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.465 ' CZ2' HD12 ' A' ' 24' ' ' LEU . 42.2 m95 -112.84 119.4 37.88 Favored 'General case' 0 C--N 1.301 -1.502 0 CA-C-O 121.021 0.439 . . . . 0.0 109.988 -177.172 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.456 ' HB2' ' HB2' ' A' ' 97' ' ' TRP . 86.5 m-85 -94.36 148.67 21.99 Favored 'General case' 0 C--N 1.277 -2.545 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.594 -176.154 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.561 ' HA ' ' O ' ' A' ' 90' ' ' ILE . 6.2 mp -98.1 139.72 33.49 Favored 'General case' 0 CA--C 1.475 -1.932 0 O-C-N 124.042 0.839 . . . . 0.0 111.008 178.567 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.401 ' HA ' ' OD1' ' A' ' 67' ' ' ASN . 59.4 t -118.44 138.68 48.37 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.878 0 N-CA-C 105.52 -2.03 . . . . 0.0 105.52 172.343 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.51 ' OD1' ' HG2' ' A' ' 36' ' ' ARG . 19.5 t0 -63.8 128.7 36.98 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 106.86 -1.533 . . . . 0.0 106.86 171.777 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 83.0 p -68.15 -27.12 66.15 Favored 'General case' 0 C--O 1.193 -1.91 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 -170.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.51 ' HG2' ' OD1' ' A' ' 34' ' ' ASP . 19.1 mmt180 -64.59 -39.34 93.55 Favored 'General case' 0 N--CA 1.433 -1.322 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.329 -175.774 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.481 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 66.8 t90 -68.41 -47.27 67.72 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 178.019 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.455 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 39.3 t80 -60.72 -39.71 89.63 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.422 -179.831 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.516 ' HA ' ' HE3' ' A' ' 42' ' ' LYS . 93.1 mttt -66.36 -32.29 73.59 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 122.819 0.448 . . . . 0.0 111.98 176.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.481 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 19.7 tp60 -68.94 -42.02 77.29 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 174.104 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.641 ' O ' HG22 ' A' ' 45' ' ' VAL . 52.9 t90 -64.45 -37.27 86.96 Favored 'General case' 0 N--CA 1.428 -1.574 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.685 177.165 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.516 ' HE3' ' HA ' ' A' ' 39' ' ' LYS . 7.2 mtmp? -51.37 -47.78 62.71 Favored 'General case' 0 C--N 1.369 1.424 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 175.222 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.47 ' HB3' ' HB2' ' A' ' 54' ' ' GLN . 63.3 mttm -55.03 -50.42 69.1 Favored 'General case' 0 CA--C 1.499 -1.009 0 O-C-N 124.178 0.924 . . . . 0.0 109.938 177.824 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.536 ' O ' ' HA ' ' A' ' 55' ' ' MET . 5.1 t80 -60.09 -38.99 84.55 Favored 'General case' 0 C--N 1.309 -1.152 0 CA-C-N 114.032 -1.44 . . . . 0.0 113.605 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.641 HG22 ' O ' ' A' ' 41' ' ' TRP . 0.2 OUTLIER -91.2 -30.04 4.8 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.519 0 N-CA-C 114.39 1.255 . . . . 0.0 114.39 -179.516 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.652 ' HA2' ' CB ' ' A' ' 52' ' ' LYS . . . 87.92 34.76 9.62 Favored Glycine 0 N--CA 1.4 -3.742 0 C-N-CA 120.229 -0.986 . . . . 0.0 112.69 -176.334 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.47 ' CD1' ' CZ ' ' A' ' 13' ' ' ARG . 89.9 t80 -60.7 -49.81 76.0 Favored 'General case' 0 CA--C 1.508 -0.672 0 CA-C-O 121.814 0.816 . . . . 0.0 110.257 177.502 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.525 ' HB3' ' HB3' ' A' ' 51' ' ' ASP . 1.5 t0 -81.94 -176.65 6.23 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 114.123 -1.399 . . . . 0.0 110.717 -168.257 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . 0.416 ' O ' ' HE2' ' A' ' 52' ' ' LYS . 16.9 m -91.68 -42.96 9.88 Favored 'General case' 0 C--N 1.292 -1.927 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.625 -177.333 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.483 ' CE2' ' HB2' ' A' ' 51' ' ' ASP . 64.8 p-90 -101.29 -20.17 15.34 Favored 'General case' 0 N--CA 1.395 -3.187 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 -176.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.525 ' HB3' ' HB3' ' A' ' 48' ' ' ASP . 31.0 t70 -103.37 78.62 1.63 Allowed 'General case' 0 CA--C 1.459 -2.548 0 CA-C-N 114.07 -1.423 . . . . 0.0 109.057 -169.343 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.652 ' CB ' ' HA2' ' A' ' 46' ' ' GLY . 65.5 pttt -169.92 3.55 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.429 0 CA-C-N 113.632 -1.622 . . . . 0.0 114.829 -174.322 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -64.6 -9.59 20.46 Favored 'General case' 0 C--N 1.299 -1.598 0 CA-C-O 121.561 0.696 . . . . 0.0 110.898 175.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.47 ' HB2' ' HB3' ' A' ' 43' ' ' LYS . 13.1 mm100 -106.62 19.32 20.66 Favored 'General case' 0 N--CA 1.416 -2.147 0 C-N-CA 124.344 1.058 . . . . 0.0 109.832 -176.319 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . 0.536 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 48.8 ttm -58.69 109.17 0.75 Allowed 'General case' 0 N--CA 1.424 -1.768 0 CA-C-O 121.444 0.64 . . . . 0.0 111.335 -178.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.91 23.9 75.31 Favored Glycine 0 N--CA 1.439 -1.131 0 CA-C-N 115.177 -0.92 . . . . 0.0 112.195 -178.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -95.04 151.88 18.8 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-O 121.115 0.483 . . . . 0.0 110.786 -175.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -83.69 -21.33 32.4 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.103 -178.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -63.51 -18.86 64.25 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.03 -0.986 . . . . 0.0 111.918 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 12.7 m -115.24 -9.12 12.3 Favored 'Isoleucine or valine' 0 CA--C 1.443 -3.172 0 CA-C-O 118.327 -0.844 . . . . 0.0 112.834 -178.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 1.6 p90 -34.34 100.47 0.19 Allowed Pre-proline 0 CA--C 1.557 1.219 0 O-C-N 126.3 2.25 . . . . 0.0 114.181 -163.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -78.29 102.46 1.57 Allowed 'Trans proline' 0 N--CA 1.425 -2.543 0 C-N-CA 122.797 2.331 . . . . 0.0 109.777 174.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -82.01 -146.87 5.91 Favored Glycine 0 C--N 1.295 -1.715 0 CA-C-N 114.29 -1.323 . . . . 0.0 111.629 177.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.454 ' HA ' ' O ' ' A' ' 104' ' ' TYR . 86.8 Cg_exo -50.23 133.92 36.68 Favored 'Trans proline' 0 C--O 1.238 0.492 0 C-N-CA 123.763 2.975 . . . . 0.0 113.82 178.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.603 HD11 ' HB3' ' A' ' 100' ' ' LEU . 45.2 mt -68.53 115.12 6.25 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 CA-C-N 114.764 -1.107 . . . . 0.0 111.437 -176.07 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -110.82 121.24 44.85 Favored 'General case' 0 C--N 1.289 -2.033 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 173.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.401 ' OD1' ' HA ' ' A' ' 33' ' ' VAL . 38.5 m-80 -109.03 18.47 20.6 Favored 'General case' 0 C--N 1.306 -1.3 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.725 -176.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 10.0 t -68.8 -2.7 10.08 Favored 'General case' 0 CA--C 1.552 1.039 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -176.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -83.74 -19.88 60.81 Favored Glycine 0 N--CA 1.441 -1.011 0 N-CA-C 111.607 -0.597 . . . . 0.0 111.607 176.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 64.7 mt -91.09 -25.89 19.4 Favored 'General case' 0 CA--C 1.499 -1.018 0 CA-C-O 121.79 0.805 . . . . 0.0 109.699 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 50.1 mt -71.36 129.48 38.93 Favored 'General case' 0 N--CA 1.421 -1.876 0 CA-C-N 114.087 -1.415 . . . . 0.0 110.892 -173.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 73.2 tttt -66.48 156.25 35.33 Favored 'General case' 0 N--CA 1.402 -2.867 0 CA-C-N 114.483 -1.235 . . . . 0.0 109.824 -178.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -73.12 105.29 4.5 Favored 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 179.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 142.55 -54.59 0.6 Allowed Glycine 0 C--N 1.309 -0.945 0 N-CA-C 111.802 -0.519 . . . . 0.0 111.802 178.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -131.64 143.83 50.59 Favored 'General case' 0 CA--C 1.484 -1.574 0 CA-C-O 120.857 0.361 . . . . 0.0 110.785 178.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -83.57 3.12 33.94 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-O 121.88 0.848 . . . . 0.0 110.567 178.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 20.8 mm-40 -112.41 -3.21 14.53 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-O 122.414 1.102 . . . . 0.0 108.221 178.162 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 68.0 m -100.74 137.45 39.12 Favored 'General case' 0 C--N 1.284 -2.252 0 CA-C-N 113.481 -1.69 . . . . 0.0 109.586 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.576 HD21 HG21 ' A' ' 113' ' ' ILE . 96.6 mt -106.94 153.02 23.16 Favored 'General case' 0 C--N 1.296 -1.718 0 CA-C-O 120.953 0.406 . . . . 0.0 111.402 -178.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.417 ' HB2' ' HG ' ' A' ' 83' ' ' LEU . 67.9 mttm -65.14 153.09 41.89 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.28 175.069 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -77.0 -33.84 57.55 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 114.581 1.326 . . . . 0.0 114.581 -169.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 19.5 t-80 -98.35 11.76 37.02 Favored 'General case' 0 C--N 1.298 -1.658 0 CA-C-O 120.696 0.284 . . . . 0.0 111.726 -172.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.417 ' HG ' ' HB2' ' A' ' 80' ' ' LYS . 83.2 mt -66.36 118.63 10.29 Favored 'General case' 0 C--N 1.307 -1.259 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -176.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.563 HG21 HD12 ' A' ' 87' ' ' LEU . 44.8 mm -92.56 170.43 1.23 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 N-CA-C 106.674 -1.602 . . . . 0.0 106.674 175.398 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.654 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 22.4 t70 -60.62 -130.53 0.0 OUTLIER 'General case' 0 CA--C 1.577 2.011 0 C-N-CA 125.472 1.509 . . . . 0.0 112.403 -177.589 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.703 ' HA ' ' O ' ' A' ' 89' ' ' TYR . 9.6 pt-20 -47.51 -17.39 0.09 Allowed 'General case' 0 N--CA 1.5 2.075 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 -176.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.563 HD12 HG21 ' A' ' 84' ' ' ILE . 11.8 mt -67.65 -54.22 21.43 Favored 'General case' 0 C--N 1.29 -2.005 0 CA-C-N 115.201 -0.909 . . . . 0.0 110.394 176.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -101.48 -33.8 9.81 Favored 'General case' 0 CA--C 1.499 -0.989 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.136 -178.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . 0.703 ' O ' ' HA ' ' A' ' 86' ' ' GLU . 4.8 p90 -141.11 -160.61 1.1 Allowed 'General case' 0 C--O 1.183 -2.398 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 -179.188 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.561 ' O ' ' HA ' ' A' ' 32' ' ' LEU . 1.2 mm -141.19 145.43 24.98 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.879 0 N-CA-C 106.908 -1.515 . . . . 0.0 106.908 172.24 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.49 HD23 ' HA ' ' A' ' 91' ' ' LEU . 58.2 mt -116.93 123.9 48.09 Favored 'General case' 0 N--CA 1.42 -1.967 0 CA-C-O 121.784 0.802 . . . . 0.0 111.122 171.035 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.55 HD11 ' HB ' ' A' ' 90' ' ' ILE . 1.0 OUTLIER -137.07 155.38 76.15 Favored Pre-proline 0 C--N 1.289 -2.049 0 CA-C-N 114.171 -1.377 . . . . 0.0 108.526 -175.493 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -61.56 169.24 7.06 Favored 'Trans proline' 0 C--O 1.255 1.338 0 C-N-CA 123.213 2.609 . . . . 0.0 110.786 176.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.468 HG22 ' ND2' ' A' ' 98' ' ' ASN . 32.3 m -47.17 -43.28 21.04 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 123.96 0.788 . . . . 0.0 109.406 173.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.536 ' HB3' ' HE2' ' A' ' 99' ' ' LYS . 9.2 mm-40 -56.28 -51.26 68.81 Favored 'General case' 0 C--O 1.196 -1.73 0 C-N-CA 124.422 1.089 . . . . 0.0 111.079 178.266 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.561 ' O ' HD22 ' A' ' 100' ' ' LEU . . . -50.87 -62.11 5.56 Favored Glycine 0 CA--C 1.497 -1.085 0 O-C-N 124.322 1.014 . . . . 0.0 111.567 -177.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.456 ' HB2' ' HB2' ' A' ' 31' ' ' TYR . 68.5 t-105 -53.5 -50.79 64.65 Favored 'General case' 0 C--N 1.309 -1.152 0 C-N-CA 123.696 0.799 . . . . 0.0 110.905 177.69 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.468 ' ND2' HG22 ' A' ' 94' ' ' THR . 91.3 m-20 -52.2 -34.57 46.08 Favored 'General case' 0 C--O 1.207 -1.148 0 O-C-N 123.562 0.539 . . . . 0.0 112.118 177.058 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.536 ' HE2' ' HB3' ' A' ' 95' ' ' GLU . 50.8 mttm -75.01 -51.67 13.01 Favored 'General case' 0 N--CA 1.412 -2.358 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.603 ' HB3' HD11 ' A' ' 65' ' ' ILE . 0.7 OUTLIER -58.95 -39.79 82.71 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.379 0.609 . . . . 0.0 111.534 -179.041 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.433 ' O ' ' HA ' ' A' ' 105' ' ' THR . 20.5 t -73.51 -31.08 31.63 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.172 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.851 177.559 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 37.5 t -73.91 -35.09 64.6 Favored 'General case' 0 C--N 1.314 -0.972 0 O-C-N 121.535 -0.728 . . . . 0.0 109.036 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' TRP . . . . . 0.672 ' CD1' ' HA ' ' A' ' 6' ' ' ALA . 49.4 m0 -78.24 -50.2 12.33 Favored 'General case' 0 N--CA 1.421 -1.924 0 CA-C-N 114.773 -1.103 . . . . 0.0 112.031 -176.731 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' TYR . . . . . 0.454 ' O ' ' HA ' ' A' ' 64' ' ' PRO . 55.2 m-85 -128.9 10.16 5.92 Favored 'General case' 0 CA--C 1.505 -0.764 0 N-CA-C 114.498 1.296 . . . . 0.0 114.498 -172.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.433 ' HA ' ' O ' ' A' ' 101' ' ' VAL 0.274 7.2 p 56.33 174.63 0.04 OUTLIER 'General case' 0 N--CA 1.418 -2.038 0 N-CA-C 117.025 2.231 . . . . 0.0 117.025 179.164 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.496 ' HG ' ' N ' ' A' ' 107' ' ' MET . 28.6 tp -104.93 161.59 14.07 Favored 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 114.57 -1.196 . . . . 0.0 108.487 -179.12 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.496 ' N ' ' HG ' ' A' ' 106' ' ' LEU . 24.4 tpp -72.19 141.06 49.04 Favored 'General case' 0 N--CA 1.38 -3.967 0 CA-C-O 122.047 0.927 . . . . 0.0 109.241 173.26 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . 0.276 6.7 tp10 -74.99 125.87 29.81 Favored 'General case' 1 N--CA 1.346 -5.625 0 CA-C-N 113.504 -1.68 . . . . 0.0 110.181 -174.547 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 104.22 -6.25 46.31 Favored Glycine 0 N--CA 1.412 -2.959 0 CA-C-N 114.589 -1.187 . . . . 0.0 112.661 177.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.443 HE21 ' HB3' ' A' ' 110' ' ' GLN . 2.3 pt20 -109.34 158.08 18.25 Favored 'General case' 0 CA--C 1.494 -1.207 0 C-N-CA 117.936 -1.505 . . . . 0.0 109.805 177.252 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -122.39 133.47 24.4 Favored Pre-proline 0 C--N 1.286 -2.187 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -177.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -41.66 133.59 3.73 Favored 'Trans proline' 0 CA--C 1.477 -2.372 0 C-N-CA 124.687 3.591 . . . . 0.0 114.671 -177.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.576 HG21 HD21 ' A' ' 79' ' ' LEU . 3.6 mp -96.34 108.74 21.71 Favored 'Isoleucine or valine' 0 N--CA 1.385 -3.709 0 CA-C-N 113.053 -1.885 . . . . 0.0 107.007 179.437 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -113.72 147.89 37.4 Favored 'General case' 0 C--N 1.283 -2.283 0 CA-C-O 122.072 0.939 . . . . 0.0 113.024 -176.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.506 ' HG2' HD11 ' A' ' 32' ' ' LEU . 3.0 mmp_? -127.02 177.62 6.52 Favored 'General case' 0 CA--C 1.476 -1.867 0 N-CA-C 105.537 -2.023 . . . . 0.0 105.537 174.002 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -134.22 166.75 22.07 Favored 'General case' 0 C--N 1.258 -3.39 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.64 HG21 ' O ' ' A' ' 25' ' ' ARG . 59.8 t -54.15 144.01 5.67 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.222 0 CA-C-O 122.493 1.139 . . . . 0.0 111.386 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 13.8 m -84.7 175.33 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.396 -3.166 0 CA-C-N 113.489 -1.687 . . . . 0.0 113.053 -172.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -62.6 -42.72 99.74 Favored 'General case' 0 N--CA 1.433 -1.322 0 CA-C-N 114.185 -1.371 . . . . 0.0 110.219 179.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 . . . . . 0 C--N 1.311 -1.08 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.039 -178.89 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.7 tmm? . . . . . 0 CA--C 1.508 -0.666 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -137.86 140.35 40.4 Favored 'General case' 0 N--CA 1.431 -1.388 0 CA-C-O 120.986 0.422 . . . . 0.0 110.54 -178.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.435 ' HB2' ' CE1' ' A' ' 104' ' ' TYR . 56.6 mm-40 -95.58 119.48 34.15 Favored 'General case' 0 C--N 1.303 -1.44 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.19 175.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -115.57 6.64 20.56 Favored Glycine 0 C--N 1.307 -1.081 0 N-CA-C 111.241 -0.743 . . . . 0.0 111.241 -179.308 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -85.74 -106.17 0.72 Allowed Glycine 0 N--CA 1.435 -1.414 0 N-CA-C 110.877 -0.889 . . . . 0.0 110.877 178.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 56.43 -158.3 0.25 Allowed 'General case' 0 C--O 1.245 0.865 0 C-N-CA 123.396 0.678 . . . . 0.0 111.84 176.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.454 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . -93.74 175.21 6.82 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 175.422 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.611 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 12.5 t70 -68.24 144.3 54.95 Favored 'General case' 0 C--N 1.291 -1.961 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 173.373 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.479 ' O ' ' HG3' ' A' ' 13' ' ' ARG . 3.1 mm? -43.63 -53.12 5.94 Favored 'General case' 0 C--N 1.298 -1.662 0 C-N-CA 125.906 1.682 . . . . 0.0 112.67 177.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -67.9 -34.49 76.73 Favored 'General case' 0 C--N 1.276 -2.604 0 CA-C-N 114.61 -1.177 . . . . 0.0 110.293 -177.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.467 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 2.9 m -66.44 -46.66 75.73 Favored 'General case' 0 N--CA 1.384 -3.747 0 CA-C-N 114.99 -1.005 . . . . 0.0 110.522 178.042 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.611 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 71.0 mt-30 -56.1 -53.82 52.46 Favored 'General case' 0 N--CA 1.444 -0.758 0 O-C-N 123.548 0.53 . . . . 0.0 110.577 -177.581 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.524 ' HG2' HG13 ' A' ' 45' ' ' VAL . 59.2 mtt180 -46.64 -58.57 3.7 Favored 'General case' 0 N--CA 1.487 1.381 0 CA-C-O 122.432 1.11 . . . . 0.0 109.798 177.208 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 54.7 m -66.89 -45.49 77.86 Favored 'General case' 0 C--N 1.295 -1.787 0 CA-C-N 113.068 -1.878 . . . . 0.0 113.306 -170.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -67.82 -32.38 72.89 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.51 -175.188 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.536 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 27.7 mm -82.5 -38.29 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.142 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.274 177.106 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.07 -34.95 72.55 Favored 'General case' 0 CA--C 1.501 -0.941 0 CA-C-O 122.027 0.917 . . . . 0.0 108.73 179.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.452 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 2.6 m -64.81 -33.88 77.04 Favored 'General case' 0 N--CA 1.401 -2.912 0 CA-C-N 113.656 -1.611 . . . . 0.0 111.299 177.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.611 ' HB3' ' CG ' ' A' ' 93' ' ' PRO . 89.7 mt -85.94 -12.97 49.12 Favored 'General case' 0 C--N 1.267 -3.003 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -176.454 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.536 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 11.6 mt -86.43 -21.63 26.99 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 176.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.452 ' HE3' ' HA ' ' A' ' 18' ' ' THR . 0.0 OUTLIER -97.75 -4.44 37.06 Favored 'General case' 0 N--CA 1.426 -1.649 0 CA-C-N 114.537 -1.21 . . . . 0.0 111.333 -174.649 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.52 ' OG1' ' HA ' ' A' ' 19' ' ' LEU . 52.8 m -54.59 134.5 46.72 Favored 'General case' 0 N--CA 1.398 -3.075 0 C-N-CA 126.291 1.836 . . . . 0.0 111.351 173.323 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 68.3 m -70.48 132.64 45.87 Favored 'General case' 0 N--CA 1.387 -3.592 0 CA-C-N 113.405 -1.725 . . . . 0.0 111.338 179.121 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.49 HD22 HG13 ' A' ' 117' ' ' VAL . 1.7 pp -110.68 159.43 17.6 Favored 'General case' 0 N--CA 1.411 -2.408 0 CA-C-N 115.353 -0.84 . . . . 0.0 112.592 179.021 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.694 ' O ' HG11 ' A' ' 117' ' ' VAL . 19.9 mmt180 -105.51 -144.68 0.38 Allowed 'General case' 0 C--N 1.271 -2.821 0 N-CA-C 103.727 -2.694 . . . . 0.0 103.727 177.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.401 ' HA ' ' HB ' ' A' ' 117' ' ' VAL . 17.6 ptpt -128.91 14.93 6.36 Favored 'General case' 0 C--N 1.283 -2.323 0 CA-C-O 122.108 0.956 . . . . 0.0 109.868 166.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -130.89 20.53 4.8 Favored Glycine 0 N--CA 1.429 -1.803 0 CA-C-N 114.149 -1.387 . . . . 0.0 112.474 -179.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 45.0 m-20 -91.03 169.61 10.73 Favored 'General case' 0 CA--C 1.492 -1.258 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 177.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.512 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 85.1 m -118.67 130.68 55.98 Favored 'General case' 0 N--CA 1.409 -2.512 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 175.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.437 ' CZ2' HD23 ' A' ' 24' ' ' LEU . 33.4 m95 -114.7 155.98 25.63 Favored 'General case' 0 C--N 1.284 -2.277 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 177.008 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.546 ' HB2' ' HB2' ' A' ' 97' ' ' TRP . 84.9 m-85 -111.25 129.83 55.85 Favored 'General case' 0 C--N 1.264 -3.152 0 CA-C-O 121.04 0.448 . . . . 0.0 110.055 -178.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.8 HD11 ' CG ' ' A' ' 89' ' ' TYR . 26.3 tp -86.84 138.96 31.14 Favored 'General case' 1 N--CA 1.376 -4.17 0 N-CA-C 114.374 1.249 . . . . 0.0 114.374 -174.841 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.511 HG12 ' O ' ' A' ' 34' ' ' ASP . 46.3 t -132.85 154.04 39.02 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.465 0 C-N-CA 126.498 1.919 . . . . 0.0 107.821 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.522 ' CA ' HD21 ' A' ' 70' ' ' LEU . 23.0 t70 -71.09 144.11 50.42 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 173.299 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.456 ' HA ' HG13 ' A' ' 90' ' ' ILE . 50.2 p -71.98 -35.65 69.57 Favored 'General case' 0 C--N 1.277 -2.578 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.337 -171.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 17.0 mmm180 -80.75 -26.53 37.25 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 120.356 -0.538 . . . . 0.0 109.705 -174.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.489 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 67.1 t90 -65.99 -46.89 76.4 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 107.622 -1.251 . . . . 0.0 107.622 177.348 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.507 ' CG ' HD12 ' A' ' 90' ' ' ILE . 33.8 t80 -65.89 -37.65 86.67 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.329 179.488 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.477 ' HA ' ' HD3' ' A' ' 42' ' ' LYS . 94.6 mttt -67.03 -29.76 69.66 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 176.169 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.489 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 22.2 tp60 -66.78 -45.91 76.97 Favored 'General case' 0 N--CA 1.406 -2.67 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 173.007 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 67.4 t90 -59.83 -41.54 91.55 Favored 'General case' 0 C--O 1.213 -0.828 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.649 176.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.538 ' HG2' ' CD1' ' A' ' 47' ' ' PHE . 15.2 mtpp -56.73 -38.19 72.04 Favored 'General case' 0 N--CA 1.44 -0.947 0 C-N-CA 123.252 0.621 . . . . 0.0 112.298 -179.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.424 ' HD3' ' NE2' ' A' ' 54' ' ' GLN . 44.1 mttp -76.54 -37.95 55.84 Favored 'General case' 0 C--N 1.281 -2.391 0 CA-C-N 116.004 -0.543 . . . . 0.0 112.251 178.589 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.632 ' HB2' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -69.03 -35.57 76.76 Favored 'General case' 0 N--CA 1.412 -2.343 0 CA-C-N 114.857 -1.065 . . . . 0.0 109.59 -179.746 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.524 HG13 ' HG2' ' A' ' 13' ' ' ARG . 2.5 p -89.93 -22.28 6.46 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.654 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -177.223 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.481 ' HA2' ' CB ' ' A' ' 52' ' ' LYS . . . 87.67 28.84 23.01 Favored Glycine 0 N--CA 1.435 -1.41 0 C-N-CA 121.122 -0.561 . . . . 0.0 112.446 -174.269 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.538 ' CD1' ' HG2' ' A' ' 42' ' ' LYS . 32.7 t80 -77.44 -35.67 53.74 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 177.703 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.472 ' HB2' ' O ' ' A' ' 51' ' ' ASP . 26.6 m-20 -76.76 103.48 6.74 Favored 'General case' 0 CA--C 1.491 -1.315 0 N-CA-C 106.061 -1.829 . . . . 0.0 106.061 172.596 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 9.2 m -54.61 -32.18 58.36 Favored 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 -176.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 45.7 p90 -95.5 -9.32 32.82 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.26 -178.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.472 ' O ' ' HB2' ' A' ' 48' ' ' ASP . 17.5 t0 -139.94 83.85 1.94 Allowed 'General case' 0 CA--C 1.487 -1.447 0 CA-C-O 122.398 1.094 . . . . 0.0 109.27 -175.349 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.481 ' CB ' ' HA2' ' A' ' 46' ' ' GLY . 55.4 pttt -145.93 16.31 1.39 Allowed 'General case' 0 N--CA 1.409 -2.504 0 CA-C-N 113.819 -1.537 . . . . 0.0 111.226 -173.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 19.9 p90 -69.11 -7.53 36.96 Favored 'General case' 0 C--N 1.285 -2.212 0 CA-C-N 114.589 -1.187 . . . . 0.0 111.115 173.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.424 ' NE2' ' HD3' ' A' ' 43' ' ' LYS . 19.7 mt-30 -102.75 12.0 36.85 Favored 'General case' 0 N--CA 1.41 -2.454 0 CA-C-N 114.591 -1.186 . . . . 0.0 109.679 -178.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . 0.574 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 33.1 ttm -60.49 113.84 2.64 Favored 'General case' 0 N--CA 1.422 -1.835 0 CA-C-O 121.698 0.761 . . . . 0.0 111.898 -179.594 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 74.25 18.87 79.87 Favored Glycine 0 N--CA 1.431 -1.69 0 CA-C-N 114.736 -1.12 . . . . 0.0 111.558 -178.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.6 ' HB3' HG22 ' A' ' 60' ' ' VAL . 4.5 t0 -88.13 145.45 25.92 Favored 'General case' 0 CA--C 1.493 -1.215 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 -177.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.442 ' O ' ' HD1' ' A' ' 61' ' ' TYR . 11.5 pt20 -83.8 -8.66 59.18 Favored 'General case' 0 C--N 1.283 -2.313 0 CA-C-O 122.329 1.062 . . . . 0.0 110.535 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -72.99 -20.42 61.02 Favored 'General case' 0 C--N 1.288 -2.092 0 CA-C-N 114.419 -1.264 . . . . 0.0 111.003 173.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.632 HG23 ' HB2' ' A' ' 44' ' ' TYR . 35.4 m -128.1 7.9 3.07 Favored 'Isoleucine or valine' 0 CA--C 1.478 -1.805 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.375 -175.229 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.456 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 2.8 p90 -63.8 115.73 21.11 Favored Pre-proline 0 C--N 1.299 -1.593 0 O-C-N 124.098 0.874 . . . . 0.0 109.39 179.492 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' A' ' 61' ' ' TYR . 9.3 Cg_endo -87.19 111.86 0.87 Allowed 'Trans proline' 0 N--CA 1.417 -2.972 0 C-N-CA 122.37 2.046 . . . . 0.0 109.562 178.721 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -67.98 -147.19 0.14 Allowed Glycine 0 C--N 1.287 -2.162 0 CA-C-N 114.94 -1.027 . . . . 0.0 112.69 176.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -57.76 136.49 75.77 Favored 'Trans proline' 0 C--O 1.249 1.065 0 C-N-CA 122.101 1.868 . . . . 0.0 112.315 -177.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.482 HG12 ' CZ2' ' A' ' 37' ' ' TRP . 61.1 mt -62.79 110.17 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.074 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.912 -177.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -102.85 118.65 37.3 Favored 'General case' 0 C--N 1.299 -1.617 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.719 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -94.87 17.88 12.9 Favored 'General case' 0 C--N 1.296 -1.721 0 CA-C-N 115.71 -0.677 . . . . 0.0 112.615 179.544 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 19.4 m -79.67 24.57 0.37 Allowed 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 -176.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.445 ' H ' HD22 ' A' ' 70' ' ' LEU . . . -111.94 -21.7 6.24 Favored Glycine 0 CA--C 1.496 -1.104 0 N-CA-C 108.702 -1.759 . . . . 0.0 108.702 175.483 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.645 HD12 ' HB3' ' A' ' 89' ' ' TYR . 0.2 OUTLIER -102.72 -42.36 5.91 Favored 'General case' 0 N--CA 1.423 -1.791 0 CA-C-N 113.006 -1.597 . . . . 0.0 108.376 -173.45 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.55 HD13 ' HA ' ' A' ' 76' ' ' ALA . 91.2 mt -65.91 150.54 48.46 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-N 113.926 -1.488 . . . . 0.0 109.229 174.37 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -74.64 -167.87 0.62 Allowed 'General case' 0 C--N 1.296 -1.758 0 CA-C-O 122.049 0.928 . . . . 0.0 111.471 -176.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -95.97 97.96 10.02 Favored 'General case' 0 C--N 1.287 -2.112 0 CA-C-N 114.963 -1.017 . . . . 0.0 108.402 -177.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 127.01 -70.66 0.5 Allowed Glycine 0 N--CA 1.438 -1.167 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.246 179.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -85.11 128.84 34.81 Favored 'General case' 0 CA--C 1.495 -1.161 0 CA-C-O 120.761 0.315 . . . . 0.0 111.651 -179.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.55 ' HA ' HD13 ' A' ' 71' ' ' LEU . . . -90.92 13.97 15.08 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 122.079 0.942 . . . . 0.0 110.301 179.578 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 20.1 mm-40 -120.45 5.91 10.64 Favored 'General case' 0 C--N 1.282 -2.339 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 53.9 m -119.39 124.29 46.22 Favored 'General case' 0 C--N 1.281 -2.408 0 CA-C-N 114.381 -1.282 . . . . 0.0 112.771 -173.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.411 HD21 HG21 ' A' ' 113' ' ' ILE . 82.6 mt -92.05 150.09 21.16 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.438 178.011 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.404 ' HB2' ' HG ' ' A' ' 83' ' ' LEU . 99.8 mttt -71.02 151.84 44.18 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.148 178.091 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -78.03 -23.54 48.16 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.798 -177.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 31.7 m170 -88.32 4.77 44.88 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -175.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.438 ' HB3' ' CE2' ' A' ' 89' ' ' TYR . 98.1 mt -65.71 133.38 50.94 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 114.497 1.295 . . . . 0.0 114.497 -173.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.736 HG21 HD12 ' A' ' 87' ' ' LEU . 43.0 mm -115.13 -178.91 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.086 0 N-CA-C 104.977 -2.231 . . . . 0.0 104.977 172.016 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.576 ' H ' HG22 ' A' ' 84' ' ' ILE . 21.7 t70 -71.54 -134.53 0.01 OUTLIER 'General case' 0 CA--C 1.57 1.724 0 CA-C-O 117.515 -1.231 . . . . 0.0 110.564 -178.074 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.674 ' HA ' ' O ' ' A' ' 89' ' ' TYR . 3.0 pp20? -45.53 -19.41 0.05 OUTLIER 'General case' 0 N--CA 1.51 2.543 0 N-CA-C 116.117 1.895 . . . . 0.0 116.117 -174.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.736 HD12 HG21 ' A' ' 84' ' ' ILE . 23.4 mt -59.76 -50.44 73.84 Favored 'General case' 0 C--N 1.287 -2.138 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.467 172.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -101.53 -50.01 3.86 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-N 114.753 -1.112 . . . . 0.0 111.342 -178.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . 0.8 ' CG ' HD11 ' A' ' 32' ' ' LEU . 0.5 OUTLIER -141.16 -175.7 4.42 Favored 'General case' 0 C--O 1.163 -3.472 0 C-N-CA 122.885 0.474 . . . . 0.0 110.968 -175.04 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.516 ' O ' HD12 ' A' ' 32' ' ' LEU . 7.1 mt -142.24 145.79 23.31 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.499 0 CA-C-N 118.943 0.792 . . . . 0.0 109.49 173.098 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.455 HD23 ' HA ' ' A' ' 91' ' ' LEU . 62.7 mt -109.72 133.58 52.96 Favored 'General case' 0 N--CA 1.405 -2.715 0 CA-C-N 114.662 -1.154 . . . . 0.0 111.841 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.402 HD22 ' N ' ' A' ' 92' ' ' LEU . 1.4 mm? -123.98 151.16 64.62 Favored Pre-proline 0 C--N 1.282 -2.332 0 CA-C-N 113.557 -1.656 . . . . 0.0 106.947 -177.57 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.611 ' CG ' ' HB3' ' A' ' 19' ' ' LEU . 11.1 Cg_endo -65.9 169.18 13.74 Favored 'Trans proline' 0 N--CA 1.443 -1.478 0 C-N-CA 121.937 1.758 . . . . 0.0 109.122 170.149 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 21.7 m -43.98 -48.35 8.66 Favored 'General case' 0 C--N 1.315 -0.917 0 O-C-N 123.518 0.512 . . . . 0.0 111.467 174.571 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -71.74 -34.69 69.73 Favored 'General case' 0 CA--C 1.491 -1.292 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.273 -176.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.547 ' O ' HD22 ' A' ' 100' ' ' LEU . . . -56.87 -62.26 6.56 Favored Glycine 0 N--CA 1.42 -2.389 0 N-CA-C 109.979 -1.248 . . . . 0.0 109.979 178.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.546 ' HB2' ' HB2' ' A' ' 31' ' ' TYR . 59.0 t-105 -50.75 -51.52 49.38 Favored 'General case' 0 N--CA 1.434 -1.227 0 C-N-CA 124.869 1.268 . . . . 0.0 110.215 176.184 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -49.15 -37.49 22.32 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 177.121 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 60.0 mttm -72.38 -51.67 19.43 Favored 'General case' 0 N--CA 1.416 -2.158 0 CA-C-O 119.434 -0.317 . . . . 0.0 110.386 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.547 HD22 ' O ' ' A' ' 96' ' ' GLY . 0.8 OUTLIER -56.94 -39.41 74.47 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.36 0.6 . . . . 0.0 111.504 179.09 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.484 ' O ' ' HA ' ' A' ' 105' ' ' THR . 53.7 t -72.26 -30.78 36.69 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.838 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.78 177.708 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 6.5 t -82.27 -24.96 34.47 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 121.07 -1.019 . . . . 0.0 108.889 -177.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' TRP . . . . . . . . . . . . . 47.2 m0 -83.64 -45.86 12.98 Favored 'General case' 0 N--CA 1.425 -1.683 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.598 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' TYR . . . . . 0.435 ' CE1' ' HB2' ' A' ' 3' ' ' GLU . 29.0 m-85 -131.42 7.64 4.56 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -175.671 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.484 ' HA ' ' O ' ' A' ' 101' ' ' VAL 0.304 35.2 p 57.77 168.37 0.04 OUTLIER 'General case' 0 N--CA 1.416 -2.139 0 N-CA-C 117.666 2.469 . . . . 0.0 117.666 -179.849 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -91.87 153.8 19.29 Favored 'General case' 0 C--N 1.291 -1.955 0 N-CA-C 105.781 -1.933 . . . . 0.0 105.781 -179.624 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 32.2 tpp -73.69 152.21 40.51 Favored 'General case' 0 N--CA 1.381 -3.913 0 CA-C-O 122.357 1.075 . . . . 0.0 110.887 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -63.6 135.31 56.7 Favored 'General case' 0 N--CA 1.395 -3.219 0 CA-C-N 112.979 -1.919 . . . . 0.0 110.006 179.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 80.25 5.77 89.55 Favored Glycine 0 N--CA 1.408 -3.203 0 CA-C-N 114.406 -1.27 . . . . 0.0 113.011 178.339 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -111.45 168.49 9.49 Favored 'General case' 0 CA--C 1.482 -1.64 0 CA-C-N 117.799 0.8 . . . . 0.0 110.975 177.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . 0.454 ' O ' HD12 ' A' ' 113' ' ' ILE . 7.5 mt-10 -142.87 144.4 29.31 Favored Pre-proline 0 C--N 1.276 -2.624 0 N-CA-C 106.511 -1.663 . . . . 0.0 106.511 -177.077 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_exo -58.58 122.76 12.19 Favored 'Trans proline' 0 CA--C 1.462 -3.101 0 C-N-CA 122.788 2.325 . . . . 0.0 112.773 -177.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.454 HD12 ' O ' ' A' ' 111' ' ' GLU . 3.2 mp -82.77 107.31 14.45 Favored 'Isoleucine or valine' 0 N--CA 1.383 -3.823 0 CA-C-N 113.248 -1.797 . . . . 0.0 107.052 175.586 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.512 ' HB1' ' CG2' ' A' ' 29' ' ' THR . . . -92.46 124.95 36.87 Favored 'General case' 0 C--N 1.274 -2.7 0 CA-C-O 121.599 0.714 . . . . 0.0 109.44 177.454 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -127.78 124.06 36.75 Favored 'General case' 0 N--CA 1.401 -2.885 0 N-CA-C 105.403 -2.073 . . . . 0.0 105.403 -176.071 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -68.52 174.14 4.41 Favored 'General case' 0 C--N 1.29 -2.008 0 CA-C-O 121.651 0.738 . . . . 0.0 112.097 -177.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.694 HG11 ' O ' ' A' ' 25' ' ' ARG . 35.1 t -67.11 149.35 11.64 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.314 0 N-CA-C 105.633 -1.988 . . . . 0.0 105.633 169.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 27.0 m -66.21 145.36 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.401 -2.88 0 CA-C-O 121.45 0.643 . . . . 0.0 110.637 -178.003 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -96.2 3.44 53.16 Favored 'General case' 0 C--N 1.279 -2.462 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.041 -175.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.426 -1.662 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 177.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.437 ' SD ' ' HA3' ' A' ' 4' ' ' GLY . 52.0 ttm . . . . . 0 CA--C 1.508 -0.656 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -85.77 98.99 11.05 Favored 'General case' 0 N--CA 1.437 -1.12 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 176.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 70.25 107.0 0.06 Allowed 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 126.037 1.735 . . . . 0.0 111.672 -177.411 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.437 ' HA3' ' SD ' ' A' ' 1' ' ' MET . . . -150.53 37.53 0.9 Allowed Glycine 0 N--CA 1.434 -1.476 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.378 178.243 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 100.53 -117.91 6.02 Favored Glycine 0 N--CA 1.444 -0.784 0 C-N-CA 120.564 -0.827 . . . . 0.0 111.627 178.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.445 ' HA ' ' CD1' ' A' ' 103' ' ' TRP . . . -150.68 171.87 16.46 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-O 121.091 0.472 . . . . 0.0 111.025 179.096 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.473 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . -83.89 176.98 8.51 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.031 -178.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.609 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 16.5 t70 -72.84 146.67 46.08 Favored 'General case' 0 CA--C 1.481 -1.695 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 176.609 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -47.88 -48.74 31.23 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 124.65 1.18 . . . . 0.0 112.095 176.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -66.65 -37.58 85.11 Favored 'General case' 0 C--N 1.282 -2.341 0 CA-C-N 113.126 -1.852 . . . . 0.0 109.924 -178.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.473 ' CG2' ' HB1' ' A' ' 7' ' ' ALA . 3.4 m -65.37 -56.73 10.97 Favored 'General case' 0 N--CA 1.387 -3.576 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.548 177.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.609 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 76.5 mt-30 -44.55 -61.34 1.58 Allowed 'General case' 0 CA--C 1.508 -0.671 0 C-N-CA 125.035 1.334 . . . . 0.0 113.193 -173.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.488 ' HB3' HG21 ' A' ' 45' ' ' VAL . 0.0 OUTLIER -66.4 -35.34 80.07 Favored 'General case' 0 N--CA 1.432 -1.352 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 -174.6 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 33.1 t -77.75 -38.98 45.72 Favored 'General case' 0 C--N 1.28 -2.45 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.776 -178.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -65.62 -39.36 91.4 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 -177.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.604 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 34.8 mm -75.27 -39.64 42.54 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.383 0 CA-C-N 114.955 -1.02 . . . . 0.0 110.475 177.218 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.18 -33.66 72.52 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-O 121.531 0.681 . . . . 0.0 109.568 -178.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.57 ' HA ' ' HE2' ' A' ' 21' ' ' LYS . 1.0 OUTLIER -67.15 -31.33 71.68 Favored 'General case' 0 N--CA 1.407 -2.605 0 CA-C-N 114.25 -1.341 . . . . 0.0 112.153 178.791 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.486 ' HB3' ' HG2' ' A' ' 93' ' ' PRO . 71.3 mt -85.94 -16.97 36.7 Favored 'General case' 0 C--N 1.276 -2.59 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -177.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 11.0 mt -86.24 -24.42 26.03 Favored 'General case' 0 CA--C 1.502 -0.888 0 CA-C-O 121.231 0.539 . . . . 0.0 110.42 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.57 ' HE2' ' HA ' ' A' ' 18' ' ' THR . 39.6 pttt -86.74 -16.67 35.67 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.907 -171.57 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.4 m -55.33 137.56 47.45 Favored 'General case' 0 N--CA 1.402 -2.871 0 C-N-CA 125.662 1.585 . . . . 0.0 111.67 173.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.4 m -78.43 168.13 20.26 Favored 'General case' 0 N--CA 1.399 -2.994 0 CA-C-N 114.033 -1.44 . . . . 0.0 108.69 174.197 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.494 HD23 ' CZ2' ' A' ' 30' ' ' TRP 0.303 72.6 mt -74.69 138.47 42.84 Favored 'General case' 0 N--CA 1.397 -3.1 0 N-CA-C 116.321 1.971 . . . . 0.0 116.321 -173.812 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.497 ' HB2' ' HB2' ' A' ' 28' ' ' ASP . 7.4 mmm180 -81.54 -178.37 6.92 Favored 'General case' 0 C--N 1.29 -1.982 0 CA-C-N 111.288 -2.687 . . . . 0.0 107.746 -177.321 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 21.6 pttp -117.3 118.88 33.47 Favored 'General case' 0 C--N 1.292 -1.894 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 176.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 58.98 45.12 95.65 Favored Glycine 0 C--O 1.238 0.381 0 CA-C-O 121.479 0.488 . . . . 0.0 111.906 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.497 ' HB2' ' HB2' ' A' ' 25' ' ' ARG . 2.0 t0 -107.32 175.33 5.53 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 -177.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 31.2 m -119.19 123.41 44.29 Favored 'General case' 0 C--N 1.277 -2.581 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 179.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.494 ' CZ2' HD23 ' A' ' 24' ' ' LEU . 60.0 m95 -107.06 145.23 32.63 Favored 'General case' 0 C--N 1.279 -2.457 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 177.348 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.545 ' HB2' ' HB2' ' A' ' 97' ' ' TRP . 76.0 m-85 -109.01 127.58 54.21 Favored 'General case' 0 C--N 1.267 -3.01 0 CA-C-O 121.17 0.51 . . . . 0.0 110.933 -177.424 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.661 HD11 ' CD1' ' A' ' 89' ' ' TYR . 23.7 tp -88.33 134.06 33.91 Favored 'General case' 0 N--CA 1.379 -3.993 0 CA-C-N 114.095 -1.411 . . . . 0.0 114.514 -174.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 41.5 t -126.88 143.55 39.96 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.728 0 C-N-CA 126.64 1.976 . . . . 0.0 108.753 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.512 ' OD1' ' HB2' ' A' ' 36' ' ' ARG . 11.0 t70 -67.82 123.37 20.38 Favored 'General case' 0 C--N 1.307 -1.257 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 172.825 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 10.7 t -66.99 -24.26 66.02 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 120.664 0.269 . . . . 0.0 110.955 -172.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.512 ' HB2' ' OD1' ' A' ' 34' ' ' ASP . 13.9 mtm-85 -74.31 -25.23 59.45 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.241 0.544 . . . . 0.0 110.633 -177.159 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 69.5 t90 -72.74 -44.82 61.17 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 107.253 -1.388 . . . . 0.0 107.253 172.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.499 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 34.9 t80 -60.84 -37.84 83.42 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 114.773 -1.103 . . . . 0.0 110.798 178.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.441 ' HA ' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -52.65 -44.14 65.95 Favored 'General case' 0 C--N 1.352 0.714 0 N-CA-C 112.141 0.423 . . . . 0.0 112.141 174.026 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 22.0 tp60 -64.54 -43.39 94.13 Favored 'General case' 0 N--CA 1.423 -1.782 0 C-N-CA 123.127 0.571 . . . . 0.0 109.756 179.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.629 ' O ' HG22 ' A' ' 45' ' ' VAL . 74.0 t90 -60.3 -40.29 90.0 Favored 'General case' 0 N--CA 1.429 -1.513 0 CA-C-N 114.642 -1.163 . . . . 0.0 111.009 179.229 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.499 ' HG3' ' O ' ' A' ' 38' ' ' PHE . 34.0 mtmt -52.08 -46.28 65.14 Favored 'General case' 0 CA--C 1.494 -1.193 0 O-C-N 123.357 0.411 . . . . 0.0 111.955 -179.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 61.6 mttm -69.33 -45.22 69.98 Favored 'General case' 0 CA--C 1.479 -1.75 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.572 -176.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.567 ' HB2' HG23 ' A' ' 60' ' ' VAL . 0.2 OUTLIER -57.96 -33.01 68.4 Favored 'General case' 0 N--CA 1.424 -1.748 0 CA-C-N 115.287 -0.869 . . . . 0.0 112.782 179.487 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.629 HG22 ' O ' ' A' ' 41' ' ' TRP . 3.7 m -95.16 -17.21 7.12 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.194 0 N-CA-C 113.692 0.997 . . . . 0.0 113.692 178.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 78.32 39.47 22.55 Favored Glycine 0 C--N 1.302 -1.325 0 N-CA-C 109.139 -1.584 . . . . 0.0 109.139 -172.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.459 ' HB2' HG23 ' A' ' 45' ' ' VAL . 46.6 t80 -74.25 -37.6 63.73 Favored 'General case' 0 N--CA 1.439 -1.012 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 178.27 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -74.23 120.92 20.46 Favored 'General case' 0 CA--C 1.49 -1.343 0 N-CA-C 106.677 -1.601 . . . . 0.0 106.677 174.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . 0.534 ' HA ' ' HE3' ' A' ' 52' ' ' LYS . 30.5 m -58.65 -31.47 68.18 Favored 'General case' 0 C--N 1.298 -1.66 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -177.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 46.2 p90 -86.21 -15.0 42.26 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.354 -178.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 45.6 t0 -122.8 95.27 4.56 Favored 'General case' 0 CA--C 1.487 -1.476 0 CA-C-O 122.489 1.138 . . . . 0.0 110.871 -174.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.534 ' HE3' ' HA ' ' A' ' 49' ' ' SER . 34.3 mmtp -119.51 5.35 11.1 Favored 'General case' 0 C--N 1.284 -2.244 0 CA-C-N 113.624 -1.625 . . . . 0.0 108.621 -178.119 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 84.1 m-85 -78.54 -27.04 45.85 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.787 -174.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.566 ' HB3' HG11 ' A' ' 60' ' ' VAL . 9.5 mm100 -92.81 -3.11 55.27 Favored 'General case' 0 N--CA 1.404 -2.726 0 CA-C-N 114.746 -1.116 . . . . 0.0 110.683 -176.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . 0.461 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 45.4 ttm -60.73 115.46 3.67 Favored 'General case' 0 N--CA 1.423 -1.808 0 C-N-CA 122.535 0.334 . . . . 0.0 110.535 -178.315 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.86 16.99 80.29 Favored Glycine 0 N--CA 1.439 -1.143 0 CA-C-N 115.437 -0.802 . . . . 0.0 112.251 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.584 ' HB3' HG22 ' A' ' 60' ' ' VAL . 5.9 t0 -91.74 147.5 22.94 Favored 'General case' 0 CA--C 1.502 -0.876 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 -178.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -83.5 -18.69 37.6 Favored 'General case' 0 C--N 1.295 -1.804 0 CA-C-O 121.909 0.861 . . . . 0.0 108.893 178.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 76.9 m-20 -62.34 -21.32 65.21 Favored 'General case' 0 CA--C 1.504 -0.815 0 CA-C-N 114.654 -1.157 . . . . 0.0 111.705 178.011 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.584 HG22 ' HB3' ' A' ' 57' ' ' ASP . 27.3 m -122.98 15.0 5.41 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.629 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.944 -176.631 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.443 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 1.1 p90 -55.89 120.14 31.14 Favored Pre-proline 0 C--N 1.292 -1.905 0 O-C-N 124.477 1.11 . . . . 0.0 111.439 -178.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.482 ' HG3' ' HA ' ' A' ' 41' ' ' TRP . 6.9 Cg_endo -91.4 115.03 0.41 Allowed 'Trans proline' 0 N--CA 1.421 -2.759 0 C-N-CA 122.909 2.406 . . . . 0.0 110.377 172.46 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -75.82 -153.85 4.58 Favored Glycine 0 C--N 1.282 -2.447 0 CA-C-N 114.256 -1.338 . . . . 0.0 111.964 175.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.412 ' HA ' ' O ' ' A' ' 104' ' ' TYR . 31.9 Cg_exo -57.35 144.08 92.23 Favored 'Trans proline' 0 C--O 1.244 0.786 0 C-N-CA 122.883 2.389 . . . . 0.0 111.88 -179.121 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 68.4 mt -64.69 118.55 7.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.22 -176.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.428 ' HB2' ' HG3' ' A' ' 107' ' ' MET . 12.6 t70 -106.85 109.46 21.37 Favored 'General case' 0 N--CA 1.436 -1.157 0 O-C-N 123.461 0.475 . . . . 0.0 110.086 179.226 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.44 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 94.9 m-20 -100.9 11.65 39.17 Favored 'General case' 0 C--N 1.297 -1.686 0 CA-C-N 115.384 -0.825 . . . . 0.0 111.644 179.403 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 75.7 m -69.9 -16.86 63.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.019 0.438 . . . . 0.0 111.089 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -72.75 -19.0 79.1 Favored Glycine 0 N--CA 1.44 -1.074 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 175.022 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.467 ' CD2' ' HB3' ' A' ' 89' ' ' TYR . 74.6 mt -96.06 -35.07 11.5 Favored 'General case' 0 CA--C 1.496 -1.134 0 CA-C-O 121.262 0.553 . . . . 0.0 109.623 177.483 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.604 HD13 ' HA ' ' A' ' 76' ' ' ALA . 87.8 mt -69.81 150.02 47.3 Favored 'General case' 0 N--CA 1.425 -1.691 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.198 -178.821 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 47.1 mtpt -69.9 -169.32 0.25 Allowed 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 -173.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -54.37 -46.53 73.03 Favored 'General case' 0 CA--C 1.496 -1.125 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 -171.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -144.59 14.22 2.01 Favored Glycine 0 C--N 1.269 -3.148 0 C-N-CA 119.45 -1.357 . . . . 0.0 113.431 -178.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -120.67 119.07 31.77 Favored 'General case' 0 CA--C 1.49 -1.346 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 178.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.604 ' HA ' HD13 ' A' ' 71' ' ' LEU . . . -92.37 19.42 7.15 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-O 121.957 0.884 . . . . 0.0 110.207 -179.255 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 16.9 mm-40 -123.42 4.07 9.07 Favored 'General case' 0 C--N 1.281 -2.38 0 N-CA-C 107.598 -1.26 . . . . 0.0 107.598 -178.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.485 ' O ' ' HA ' ' A' ' 71' ' ' LEU . 70.7 m -132.6 131.93 41.97 Favored 'General case' 0 C--N 1.286 -2.153 0 CA-C-N 114.296 -1.32 . . . . 0.0 112.368 -173.166 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 36.7 tp -94.97 143.92 26.09 Favored 'General case' 0 N--CA 1.389 -3.524 0 C-N-CA 125.438 1.495 . . . . 0.0 108.706 -178.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 56.1 mtmt -66.94 158.15 31.52 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 -178.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -69.81 -49.91 48.09 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 114.336 1.236 . . . . 0.0 114.336 -167.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 29.9 m170 -93.48 12.01 26.57 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.439 0.903 . . . . 0.0 113.439 -170.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 16.3 mt -72.69 130.38 40.39 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-O 121.701 0.762 . . . . 0.0 112.555 -174.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.658 HG21 HD12 ' A' ' 87' ' ' LEU . 50.7 mm -101.19 175.13 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.935 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 -179.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.566 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 6.3 p-10 -64.59 -141.15 0.0 OUTLIER 'General case' 0 C--O 1.2 -1.538 0 C-N-CA 124.915 1.286 . . . . 0.0 112.158 -177.601 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.547 ' HA ' ' O ' ' A' ' 89' ' ' TYR . 0.0 OUTLIER -40.88 -19.9 0.01 OUTLIER 'General case' 0 N--CA 1.516 2.868 0 N-CA-C 115.804 1.779 . . . . 0.0 115.804 -173.865 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.658 HD12 HG21 ' A' ' 84' ' ' ILE . 15.2 mt -58.4 -53.52 57.41 Favored 'General case' 0 C--N 1.29 -2.017 0 C-N-CA 124.056 0.943 . . . . 0.0 109.88 171.618 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -107.11 -40.57 5.39 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.266 0.555 . . . . 0.0 111.138 -178.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . 0.661 ' CD1' HD11 ' A' ' 32' ' ' LEU . 1.8 p90 -140.31 174.13 10.82 Favored 'General case' 0 C--O 1.159 -3.671 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.832 -175.091 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.506 ' O ' HD12 ' A' ' 32' ' ' LEU . 6.0 mt -138.81 143.83 31.13 Favored 'Isoleucine or valine' 0 CA--C 1.481 -1.709 0 O-C-N 120.899 -1.126 . . . . 0.0 110.811 178.054 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.48 ' HA ' HD23 ' A' ' 91' ' ' LEU . 57.5 mt -106.24 128.11 53.72 Favored 'General case' 0 N--CA 1.404 -2.738 0 CA-C-N 114.183 -1.371 . . . . 0.0 111.838 177.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -115.92 149.75 43.8 Favored Pre-proline 0 C--N 1.272 -2.799 0 CA-C-N 113.064 -1.88 . . . . 0.0 106.236 -178.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.486 ' HG2' ' HB3' ' A' ' 19' ' ' LEU . 38.8 Cg_exo -65.36 169.13 12.97 Favored 'Trans proline' 0 N--CA 1.439 -1.679 0 N-CA-C 107.782 -1.661 . . . . 0.0 107.782 168.071 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 10.4 m -40.38 -47.96 2.64 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 123.928 0.767 . . . . 0.0 110.633 172.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -68.06 -39.8 82.93 Favored 'General case' 0 C--O 1.208 -1.129 0 CA-C-N 114.637 -1.165 . . . . 0.0 112.047 -175.054 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.475 ' O ' ' HG ' ' A' ' 100' ' ' LEU . . . -61.19 -52.89 48.96 Favored Glycine 0 N--CA 1.433 -1.518 0 N-CA-C 110.619 -0.992 . . . . 0.0 110.619 -178.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.545 ' HB2' ' HB2' ' A' ' 31' ' ' TYR . 69.5 t-105 -55.66 -53.33 57.81 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 123.596 0.758 . . . . 0.0 110.273 174.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 97.0 m-20 -46.86 -41.47 15.77 Favored 'General case' 0 C--O 1.199 -1.591 0 C-N-CA 123.349 0.66 . . . . 0.0 111.688 176.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.436 ' HB2' ' O ' ' A' ' 96' ' ' GLY . 41.6 mttm -64.46 -53.88 41.34 Favored 'General case' 0 CA--C 1.477 -1.862 0 CA-C-O 121.553 0.692 . . . . 0.0 109.989 -178.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 96' ' ' GLY . 77.8 mt -65.53 -33.42 75.88 Favored 'General case' 0 C--N 1.265 -3.096 0 CA-C-N 114.502 -1.226 . . . . 0.0 112.694 -176.148 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.428 ' O ' ' HA ' ' A' ' 105' ' ' THR . 48.1 t -79.64 -25.81 12.37 Favored 'Isoleucine or valine' 0 N--CA 1.4 -2.956 0 CA-C-O 121.494 0.664 . . . . 0.0 110.864 176.04 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 62.4 m -76.2 -38.04 57.01 Favored 'General case' 0 N--CA 1.419 -1.998 0 O-C-N 121.189 -0.944 . . . . 0.0 109.621 175.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' TRP . . . . . 0.445 ' CD1' ' HA ' ' A' ' 6' ' ' ALA . 28.8 m0 -82.17 -44.13 16.82 Favored 'General case' 0 N--CA 1.435 -1.215 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.424 -177.295 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' TYR . . . . . 0.412 ' O ' ' HA ' ' A' ' 64' ' ' PRO . 36.7 m-85 -119.95 -12.12 9.2 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -172.431 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.428 ' HA ' ' O ' ' A' ' 101' ' ' VAL 0.333 11.7 t 53.63 -174.44 0.03 OUTLIER 'General case' 0 C--O 1.24 0.604 0 C-N-CA 126.501 1.92 . . . . 0.0 114.009 -172.9 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -105.32 148.33 27.16 Favored 'General case' 0 C--N 1.248 -3.848 0 CA-C-N 113.425 -1.716 . . . . 0.0 109.212 -171.694 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.428 ' HG3' ' HB2' ' A' ' 66' ' ' ASP . 68.4 mmm -73.13 156.92 38.16 Favored 'General case' 0 CA--C 1.504 -0.822 0 CA-C-O 120.926 0.393 . . . . 0.0 111.503 175.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -61.17 148.37 40.99 Favored 'General case' 0 C--N 1.31 -1.12 0 C-N-CA 124.55 1.14 . . . . 0.0 112.011 -179.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 78.49 -23.89 2.77 Favored Glycine 0 N--CA 1.432 -1.588 0 CA-C-N 114.535 -1.212 . . . . 0.0 113.551 175.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -85.37 159.39 20.01 Favored 'General case' 0 N--CA 1.426 -1.661 0 CA-C-O 121.672 0.748 . . . . 0.0 111.175 -176.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -134.98 156.03 78.73 Favored Pre-proline 0 C--N 1.273 -2.743 0 N-CA-C 106.303 -1.74 . . . . 0.0 106.303 175.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -58.36 122.44 11.68 Favored 'Trans proline' 0 CA--C 1.469 -2.726 0 C-N-CA 122.431 2.088 . . . . 0.0 111.159 176.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.53 ' HB ' ' HB3' ' A' ' 32' ' ' LEU . 63.0 mt -84.42 106.63 14.8 Favored 'Isoleucine or valine' 0 N--CA 1.381 -3.879 0 CA-C-N 113.028 -1.896 . . . . 0.0 106.933 179.085 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -94.74 125.76 39.61 Favored 'General case' 0 C--N 1.27 -2.883 0 CA-C-O 121.725 0.774 . . . . 0.0 110.377 -179.451 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 10.1 tpt180 -125.72 115.05 19.47 Favored 'General case' 0 N--CA 1.4 -2.952 0 N-CA-C 105.31 -2.107 . . . . 0.0 105.31 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -73.53 166.19 23.69 Favored 'General case' 0 C--N 1.274 -2.683 0 C-N-CA 120.37 -0.532 . . . . 0.0 111.103 -179.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 87.3 t -50.44 144.88 1.74 Allowed 'Isoleucine or valine' 0 C--O 1.242 0.677 0 O-C-N 124.0 0.813 . . . . 0.0 109.595 178.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 30.4 m -42.37 138.79 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.413 -2.314 0 C-N-CA 126.699 2.0 . . . . 0.0 116.027 -170.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -62.85 -26.95 69.01 Favored 'General case' 0 C--N 1.293 -1.872 0 CA-C-N 112.281 -2.236 . . . . 0.0 110.707 178.055 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 . . . . . 0 C--N 1.298 -1.635 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.124 -178.509 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 mpt? . . . . . 0 N--CA 1.473 0.691 0 CA-C-O 121.214 0.53 . . . . 0.0 110.53 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -149.61 31.96 0.72 Allowed 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -176.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -62.07 107.83 0.94 Allowed 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 114.308 -1.315 . . . . 0.0 112.104 -174.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -147.65 6.53 1.04 Allowed Glycine 0 N--CA 1.44 -1.07 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.169 178.267 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -152.37 59.52 0.41 Allowed Glycine 0 CA--C 1.482 -1.977 0 N-CA-C 110.844 -0.902 . . . . 0.0 110.844 -179.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.566 ' HA ' ' CD1' ' A' ' 103' ' ' TRP . . . -122.38 144.78 48.81 Favored 'General case' 0 N--CA 1.419 -1.989 0 CA-C-O 121.692 0.758 . . . . 0.0 112.471 -179.631 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.491 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . -73.13 166.53 22.94 Favored 'General case' 0 C--N 1.305 -1.344 0 CA-C-N 114.024 -1.444 . . . . 0.0 110.806 178.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.693 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 25.0 t70 -70.58 146.27 50.21 Favored 'General case' 0 CA--C 1.465 -2.299 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 174.545 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.496 ' O ' ' HG2' ' A' ' 13' ' ' ARG . 28.5 mt -53.79 -43.88 69.67 Favored 'General case' 0 CA--C 1.487 -1.454 0 CA-C-N 119.085 0.857 . . . . 0.0 111.166 -177.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -68.24 -24.19 64.88 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 114.897 -1.047 . . . . 0.0 110.094 -176.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.583 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 5.1 m -78.79 -50.77 10.75 Favored 'General case' 0 N--CA 1.38 -3.931 0 CA-C-N 114.498 -1.228 . . . . 0.0 109.462 175.092 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.693 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 52.0 mt-30 -49.16 -61.12 2.25 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.966 0.906 . . . . 0.0 112.298 -175.42 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.496 ' HG2' ' O ' ' A' ' 9' ' ' LEU . 1.6 ptm180 -49.05 -43.43 40.79 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-O 121.701 0.763 . . . . 0.0 112.356 177.619 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.4 m -75.32 -34.6 61.25 Favored 'General case' 0 C--N 1.278 -2.534 0 CA-C-N 114.549 -1.205 . . . . 0.0 112.493 -176.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.5 t0 -77.08 -36.74 55.55 Favored 'General case' 0 C--N 1.3 -1.582 0 C-N-CA 123.786 0.834 . . . . 0.0 109.628 -177.01 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.61 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 27.3 mm -73.12 -33.05 41.13 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.244 0 C-N-CA 123.235 0.614 . . . . 0.0 110.468 177.056 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.34 -36.46 71.19 Favored 'General case' 0 CA--C 1.502 -0.89 0 O-C-N 123.855 0.722 . . . . 0.0 109.092 -178.019 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.549 ' O ' ' HG3' ' A' ' 21' ' ' LYS . 24.7 m -54.15 -57.12 12.32 Favored 'General case' 0 N--CA 1.405 -2.708 0 C-N-CA 125.757 1.623 . . . . 0.0 111.096 177.663 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.518 ' HB3' ' HD2' ' A' ' 93' ' ' PRO . 2.7 mm? -66.81 -18.05 65.19 Favored 'General case' 1 N--CA 1.377 -4.099 0 N-CA-C 114.63 1.345 . . . . 0.0 114.63 -178.213 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.61 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 10.0 mt -84.43 -26.08 28.53 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-O 121.64 0.733 . . . . 0.0 109.442 178.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.549 ' HG3' ' O ' ' A' ' 18' ' ' THR . 0.0 OUTLIER -91.86 -7.57 48.95 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-N 114.667 -1.152 . . . . 0.0 110.822 -173.628 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 51.9 m -71.25 139.07 49.91 Favored 'General case' 0 N--CA 1.394 -3.275 0 CA-C-N 113.354 -1.748 . . . . 0.0 111.138 177.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 73.7 m -87.3 132.22 34.0 Favored 'General case' 0 N--CA 1.389 -3.501 0 CA-C-N 113.777 -1.556 . . . . 0.0 109.61 176.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.659 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP . 0.6 OUTLIER -80.21 160.09 25.73 Favored 'General case' 0 C--N 1.296 -1.756 0 N-CA-C 114.21 1.189 . . . . 0.0 114.21 -176.969 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.433 ' O ' HG21 ' A' ' 117' ' ' VAL . 0.0 OUTLIER -101.74 144.08 30.88 Favored 'General case' 0 C--N 1.295 -1.802 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 177.348 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -54.51 -22.2 12.24 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 116.649 2.092 . . . . 0.0 116.649 -169.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -134.7 33.53 2.47 Favored Glycine 0 C--N 1.293 -1.808 0 N-CA-C 110.409 -1.076 . . . . 0.0 110.409 -179.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.421 ' HB2' ' HB2' ' A' ' 25' ' ' ARG . 2.5 t70 -85.54 -177.17 6.36 Favored 'General case' 0 C--N 1.315 -0.933 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.285 -178.212 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.515 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 85.6 m -129.04 121.67 28.39 Favored 'General case' 0 N--CA 1.438 -1.061 0 CA-C-O 121.375 0.607 . . . . 0.0 110.249 -177.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.659 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 15.2 m95 -113.31 148.97 34.62 Favored 'General case' 0 N--CA 1.424 -1.767 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.35 -179.043 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.405 ' HB2' ' HB2' ' A' ' 97' ' ' TRP . 86.7 m-85 -106.68 142.68 35.94 Favored 'General case' 0 C--N 1.292 -1.922 0 C-N-CA 123.07 0.548 . . . . 0.0 111.385 -175.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.633 HD13 HG22 ' A' ' 113' ' ' ILE . 6.2 mp -93.17 133.18 36.62 Favored 'General case' 0 CA--C 1.496 -1.096 0 CA-C-O 122.184 0.992 . . . . 0.0 113.606 -177.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.439 HG12 ' O ' ' A' ' 34' ' ' ASP . 53.4 t -117.06 142.45 30.89 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.484 0 N-CA-C 104.845 -2.28 . . . . 0.0 104.845 174.046 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.439 ' O ' HG12 ' A' ' 33' ' ' VAL . 4.5 t0 -67.28 127.7 33.65 Favored 'General case' 0 C--N 1.288 -2.078 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 172.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 6.5 t -66.46 -30.16 70.44 Favored 'General case' 0 N--CA 1.423 -1.789 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 -174.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 47.1 mtp85 -71.52 -29.78 65.17 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.149 -176.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.445 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 70.6 t90 -69.6 -46.96 65.09 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 173.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.492 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 28.9 t80 -61.53 -41.88 97.99 Favored 'General case' 0 C--O 1.212 -0.886 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.075 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.495 ' HA ' ' HE3' ' A' ' 42' ' ' LYS . 0.1 OUTLIER -55.5 -41.2 72.75 Favored 'General case' 0 N--CA 1.439 -1.004 0 O-C-N 122.007 -0.433 . . . . 0.0 111.855 175.091 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.445 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 21.5 tp60 -65.45 -42.38 92.4 Favored 'General case' 0 N--CA 1.423 -1.81 0 C-N-CA 123.495 0.718 . . . . 0.0 109.698 176.45 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 65.2 t90 -61.1 -39.98 92.01 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.592 177.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.495 ' HE3' ' HA ' ' A' ' 39' ' ' LYS . 8.3 mtmp? -56.99 -42.81 80.93 Favored 'General case' 0 CA--C 1.495 -1.17 0 CA-C-N 117.948 0.34 . . . . 0.0 110.991 -179.691 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.514 ' HB3' ' HB2' ' A' ' 54' ' ' GLN . 93.5 mttt -58.63 -52.14 66.95 Favored 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 124.175 0.922 . . . . 0.0 109.283 178.37 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.528 ' HB2' HG23 ' A' ' 60' ' ' VAL . 0.4 OUTLIER -65.55 -41.13 93.34 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-N 114.175 -1.375 . . . . 0.0 112.482 -172.48 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.423 ' CG1' ' HB2' ' A' ' 47' ' ' PHE . 3.7 p -90.47 -12.72 9.44 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.721 0 CA-C-N 116.313 -0.403 . . . . 0.0 112.026 -175.678 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.776 ' HA2' ' HB2' ' A' ' 52' ' ' LYS . . . 64.23 45.32 93.89 Favored Glycine 0 N--CA 1.4 -3.72 0 C-N-CA 121.183 -0.532 . . . . 0.0 112.689 -171.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.423 ' HB2' ' CG1' ' A' ' 45' ' ' VAL . 94.5 t80 -66.44 -52.94 41.11 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 123.607 0.763 . . . . 0.0 112.002 -178.254 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.468 ' OD1' ' HB3' ' A' ' 42' ' ' LYS . 16.5 p-10 -99.08 99.64 10.68 Favored 'General case' 0 C--N 1.289 -2.051 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.923 -176.074 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 8.9 m -49.8 -29.73 8.41 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 125.547 1.539 . . . . 0.0 114.158 -176.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.432 ' CE2' ' HB2' ' A' ' 48' ' ' ASP . 49.1 p90 -72.56 -11.66 60.74 Favored 'General case' 0 C--N 1.322 -0.589 0 O-C-N 122.044 -0.41 . . . . 0.0 111.428 179.377 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.437 ' O ' ' HD2' ' A' ' 52' ' ' LYS . 20.1 t70 -129.26 -94.34 0.42 Allowed 'General case' 0 C--N 1.304 -1.387 0 CA-C-O 118.508 -0.758 . . . . 0.0 109.769 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.776 ' HB2' ' HA2' ' A' ' 46' ' ' GLY . 0.0 OUTLIER 42.8 29.11 0.15 Allowed 'General case' 0 CA--C 1.554 1.12 0 N-CA-C 116.392 1.997 . . . . 0.0 116.392 172.087 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.422 ' HD1' ' H ' ' A' ' 53' ' ' TYR . 1.6 p90 -63.82 -5.08 3.77 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 115.407 1.632 . . . . 0.0 115.407 -173.343 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.514 ' HB2' ' HB3' ' A' ' 43' ' ' LYS . 11.2 mm100 -128.1 23.86 6.03 Favored 'General case' 0 C--N 1.285 -2.213 0 C-N-CA 124.015 0.926 . . . . 0.0 110.651 -171.321 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 50.4 ttm -57.0 108.26 0.49 Allowed 'General case' 0 N--CA 1.437 -1.098 0 C-N-CA 124.052 0.941 . . . . 0.0 110.784 -179.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.27 16.84 73.14 Favored Glycine 0 N--CA 1.434 -1.464 0 CA-C-N 115.855 -0.611 . . . . 0.0 112.299 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.552 ' HB3' HG22 ' A' ' 60' ' ' VAL . 7.6 t0 -86.97 148.56 25.27 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 178.405 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.464 ' O ' ' HD1' ' A' ' 61' ' ' TYR . 28.6 pt20 -85.19 -23.26 28.41 Favored 'General case' 0 C--N 1.292 -1.931 0 CA-C-O 121.493 0.663 . . . . 0.0 111.287 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 -62.04 -18.16 59.73 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-O 121.93 0.871 . . . . 0.0 111.699 -179.309 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.552 HG22 ' HB3' ' A' ' 57' ' ' ASP . 29.3 m -116.64 8.22 7.22 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.098 0 CA-C-N 115.028 -0.987 . . . . 0.0 112.225 -173.154 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.464 ' HD1' ' O ' ' A' ' 58' ' ' GLN . 2.8 p90 -60.37 116.85 19.62 Favored Pre-proline 0 C--N 1.308 -1.215 0 O-C-N 124.215 0.947 . . . . 0.0 110.681 -179.484 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 61' ' ' TYR . 7.7 Cg_endo -89.94 110.48 0.43 Allowed 'Trans proline' 0 N--CA 1.42 -2.818 0 C-N-CA 122.695 2.264 . . . . 0.0 109.39 175.411 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -69.66 -146.79 0.26 Allowed Glycine 0 C--N 1.291 -1.935 0 CA-C-N 115.03 -0.986 . . . . 0.0 112.879 177.307 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.637 ' HA ' ' O ' ' A' ' 104' ' ' TYR . 32.8 Cg_exo -55.34 134.47 64.06 Favored 'Trans proline' 0 C--O 1.247 0.94 0 C-N-CA 122.778 2.319 . . . . 0.0 112.2 -177.167 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.447 HD11 ' HB3' ' A' ' 100' ' ' LEU . 78.9 mt -62.29 125.14 18.12 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.039 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.433 -178.216 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.474 ' HB3' ' SD ' ' A' ' 107' ' ' MET . 7.1 p-10 -108.38 122.37 46.86 Favored 'General case' 0 N--CA 1.407 -2.602 0 CA-C-O 122.247 1.022 . . . . 0.0 109.222 177.797 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.567 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 13.4 m120 -100.52 9.65 42.26 Favored 'General case' 0 C--N 1.279 -2.47 0 N-CA-C 107.189 -1.412 . . . . 0.0 107.189 171.182 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 6.0 m -57.28 -34.25 68.47 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 124.965 1.306 . . . . 0.0 111.12 -178.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -77.91 -13.01 83.86 Favored Glycine 0 N--CA 1.438 -1.171 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.272 178.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 36.6 mt -100.03 -14.77 18.49 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 179.446 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.567 ' HG ' ' O ' ' A' ' 67' ' ' ASN . 99.6 mt -80.43 139.19 36.58 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.863 -178.426 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -80.24 179.81 7.47 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.581 175.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -96.97 88.65 4.58 Favored 'General case' 0 C--N 1.288 -2.068 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -174.23 -56.23 0.05 OUTLIER Glycine 0 N--CA 1.426 -1.992 0 N-CA-C 111.015 -0.834 . . . . 0.0 111.015 -178.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.492 ' OD2' ' HG2' ' A' ' 77' ' ' GLN . 4.5 t70 -141.72 -169.63 2.94 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 107.139 -1.43 . . . . 0.0 107.139 177.331 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.464 ' HA ' HD13 ' A' ' 71' ' ' LEU . . . -110.2 11.83 23.52 Favored 'General case' 0 C--N 1.295 -1.793 0 CA-C-O 121.898 0.856 . . . . 0.0 109.254 177.858 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.492 ' HG2' ' OD2' ' A' ' 75' ' ' ASP . 56.8 mm-40 -118.66 -2.63 10.93 Favored 'General case' 0 C--N 1.299 -1.61 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 179.531 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 24.2 p -90.87 116.89 29.04 Favored 'General case' 0 N--CA 1.424 -1.764 0 CA-C-N 113.854 -1.521 . . . . 0.0 109.729 -177.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 19.1 tp -98.29 138.86 34.93 Favored 'General case' 0 N--CA 1.39 -3.444 0 C-N-CA 124.371 1.068 . . . . 0.0 110.068 -176.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.465 ' CB ' HD13 ' A' ' 83' ' ' LEU . 68.3 mttm -61.31 139.09 58.23 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.556 0.693 . . . . 0.0 111.26 177.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -89.28 -19.51 25.25 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-N 114.722 -1.126 . . . . 0.0 113.918 -168.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 28.5 m170 -86.28 -10.98 53.47 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -175.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.465 HD13 ' CB ' ' A' ' 80' ' ' LYS . 8.2 mp -76.77 139.2 40.32 Favored 'General case' 0 C--N 1.295 -1.768 0 N-CA-C 114.948 1.462 . . . . 0.0 114.948 -172.297 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.615 HG21 HD12 ' A' ' 87' ' ' LEU . 58.0 mt -101.05 178.06 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.426 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 176.339 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.719 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 12.2 t70 -64.87 -130.72 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.557 0 C-N-CA 124.372 1.069 . . . . 0.0 110.186 -177.295 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.42 ' HA ' ' O ' ' A' ' 89' ' ' TYR . 6.8 tp10 -38.43 -24.08 0.01 OUTLIER 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 127.585 2.354 . . . . 0.0 114.792 -179.192 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.615 HD12 HG21 ' A' ' 84' ' ' ILE . 18.6 mt -66.43 -47.5 73.03 Favored 'General case' 0 C--N 1.284 -2.28 0 C-N-CA 123.33 0.652 . . . . 0.0 110.821 177.159 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -113.63 -34.28 5.58 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.41 -175.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . 0.719 ' CE1' ' HA ' ' A' ' 85' ' ' ASP . 3.7 p90 -142.41 -163.87 1.7 Allowed 'General case' 0 C--O 1.187 -2.227 0 N-CA-C 106.315 -1.735 . . . . 0.0 106.315 -179.433 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.564 ' O ' ' HA ' ' A' ' 32' ' ' LEU . 4.7 mt -147.68 148.2 16.6 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.235 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 171.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.541 HD21 ' CD1' ' A' ' 32' ' ' LEU . 26.6 mt -109.81 126.2 53.54 Favored 'General case' 0 N--CA 1.397 -3.113 0 O-C-N 124.532 1.145 . . . . 0.0 111.476 175.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.411 HD23 HG23 ' A' ' 33' ' ' VAL . 1.6 mm? -118.86 149.51 46.74 Favored Pre-proline 0 C--N 1.306 -1.317 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.686 -177.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.518 ' HD2' ' HB3' ' A' ' 19' ' ' LEU . 50.0 Cg_exo -61.71 168.67 8.14 Favored 'Trans proline' 0 C--O 1.257 1.465 0 C-N-CA 122.051 1.834 . . . . 0.0 108.51 164.626 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 19.5 m -46.79 -41.01 14.74 Favored 'General case' 0 C--N 1.306 -1.321 0 O-C-N 123.607 0.567 . . . . 0.0 111.05 174.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 5.8 mp0 -61.96 -52.7 62.95 Favored 'General case' 0 CA--C 1.5 -0.95 0 C-N-CA 124.538 1.135 . . . . 0.0 111.046 -178.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.478 ' O ' ' HG ' ' A' ' 100' ' ' LEU . . . -56.07 -54.28 36.6 Favored Glycine 0 N--CA 1.429 -1.795 0 O-C-N 124.015 0.822 . . . . 0.0 111.848 -176.456 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.405 ' HB2' ' HB2' ' A' ' 31' ' ' TYR . 70.9 t-105 -55.65 -51.09 68.38 Favored 'General case' 0 N--CA 1.425 -1.724 0 C-N-CA 123.007 0.523 . . . . 0.0 111.312 176.148 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 -52.37 -34.97 50.21 Favored 'General case' 0 CA--C 1.485 -1.533 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 177.071 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.447 ' HB2' ' O ' ' A' ' 96' ' ' GLY . 54.2 mttm -67.01 -52.11 46.51 Favored 'General case' 0 CA--C 1.468 -2.21 0 CA-C-O 121.375 0.607 . . . . 0.0 110.419 178.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 96' ' ' GLY . 69.1 mt -65.99 -35.92 81.89 Favored 'General case' 0 C--N 1.261 -3.25 0 CA-C-N 114.752 -1.113 . . . . 0.0 111.945 -175.683 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.497 ' HA ' ' HA ' ' A' ' 105' ' ' THR . 18.6 t -77.59 -25.41 14.8 Favored 'Isoleucine or valine' 0 N--CA 1.399 -2.995 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.723 174.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 38.2 t -74.46 -38.22 63.02 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 176.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' TRP . . . . . 0.566 ' CD1' ' HA ' ' A' ' 6' ' ' ALA . 36.7 m0 -77.85 -54.56 6.18 Favored 'General case' 0 N--CA 1.422 -1.834 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.201 -176.022 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' TYR . . . . . 0.637 ' O ' ' HA ' ' A' ' 64' ' ' PRO . 30.9 m-85 -127.88 13.21 6.82 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 114.255 1.206 . . . . 0.0 114.255 -175.505 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' A' ' 101' ' ' VAL 0.252 10.0 t 47.28 -170.05 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 126.256 1.822 . . . . 0.0 115.473 178.755 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 52.6 tp -115.39 142.15 47.08 Favored 'General case' 0 C--N 1.26 -3.309 0 CA-C-N 113.29 -1.777 . . . . 0.0 109.006 -175.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.474 ' SD ' ' HB3' ' A' ' 66' ' ' ASP . 72.9 mtp -63.18 156.37 25.44 Favored 'General case' 0 CA--C 1.508 -0.656 0 CA-C-O 122.155 0.979 . . . . 0.0 113.621 178.6 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -71.53 147.66 47.5 Favored 'General case' 0 N--CA 1.413 -2.32 0 CA-C-N 113.967 -1.469 . . . . 0.0 111.533 178.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 94.76 -24.48 27.93 Favored Glycine 0 N--CA 1.418 -2.545 0 CA-C-N 114.926 -1.034 . . . . 0.0 113.504 175.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -113.65 169.86 8.67 Favored 'General case' 0 N--CA 1.421 -1.914 0 CA-C-O 120.698 0.285 . . . . 0.0 110.501 -177.217 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 65.8 mm-40 -137.1 155.57 76.01 Favored Pre-proline 0 C--N 1.301 -1.503 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 -177.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_exo -56.62 124.57 16.57 Favored 'Trans proline' 0 CA--C 1.463 -3.047 0 C-N-CA 123.498 2.798 . . . . 0.0 113.012 -177.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.633 HG22 HD13 ' A' ' 32' ' ' LEU . 2.6 mp -83.36 110.21 17.96 Favored 'Isoleucine or valine' 0 N--CA 1.384 -3.755 0 N-CA-C 106.534 -1.654 . . . . 0.0 106.534 175.292 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.515 ' HB1' ' CG2' ' A' ' 29' ' ' THR . . . -107.13 132.85 52.56 Favored 'General case' 0 C--N 1.281 -2.387 0 CA-C-N 115.426 -0.806 . . . . 0.0 108.901 178.515 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.549 ' HB2' HD11 ' A' ' 32' ' ' LEU . 5.4 tpt180 -130.33 135.24 47.85 Favored 'General case' 0 N--CA 1.407 -2.616 0 N-CA-C 105.706 -1.961 . . . . 0.0 105.706 -178.505 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -84.23 168.58 15.6 Favored 'General case' 0 C--N 1.272 -2.792 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -175.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.433 HG21 ' O ' ' A' ' 25' ' ' ARG . 90.4 t -69.38 148.04 11.67 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.967 0 CA-C-O 122.376 1.084 . . . . 0.0 111.177 -177.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 15.3 m -76.81 -176.05 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.276 -2.589 0 CA-C-N 113.016 -1.902 . . . . 0.0 113.229 -173.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.475 ' CD ' ' H ' ' A' ' 119' ' ' GLU . 0.1 OUTLIER -93.95 -15.56 24.81 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-N 114.703 -1.135 . . . . 0.0 111.665 -176.757 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 27.8 pt20 . . . . . 0 C--N 1.321 -0.651 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 177.125 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.242 0.673 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -161.69 122.39 2.68 Favored 'General case' 0 N--CA 1.441 -0.889 0 N-CA-C 108.825 -0.805 . . . . 0.0 108.825 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -73.5 111.14 8.36 Favored 'General case' 0 N--CA 1.421 -1.894 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 178.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -120.32 -0.41 12.7 Favored Glycine 0 N--CA 1.441 -1.023 0 CA-C-N 115.799 -0.637 . . . . 0.0 112.419 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -89.01 -40.46 6.17 Favored Glycine 0 CA--C 1.492 -1.345 0 N-CA-C 108.009 -2.036 . . . . 0.0 108.009 178.046 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -104.32 -176.41 3.07 Favored 'General case' 0 N--CA 1.42 -1.926 0 N-CA-C 105.868 -1.901 . . . . 0.0 105.868 171.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.541 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . -92.8 155.24 17.78 Favored 'General case' 0 C--N 1.285 -2.227 0 C-N-CA 119.708 -0.797 . . . . 0.0 111.213 -179.634 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.607 ' O ' ' HB ' ' A' ' 11' ' ' THR . 19.6 t70 -78.37 157.55 29.04 Favored 'General case' 0 C--O 1.178 -2.7 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 176.327 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.471 ' O ' ' HG3' ' A' ' 13' ' ' ARG . 32.5 mt -59.1 -33.89 71.36 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 118.945 0.793 . . . . 0.0 111.608 -177.065 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.409 ' HA ' ' NH1' ' A' ' 13' ' ' ARG . 18.4 t70 -73.13 -30.0 63.3 Favored 'General case' 0 C--N 1.281 -2.396 0 CA-C-N 114.003 -1.453 . . . . 0.0 108.965 -178.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.607 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 56.2 m -78.12 -49.74 13.33 Favored 'General case' 0 N--CA 1.382 -3.837 0 CA-C-N 113.887 -1.506 . . . . 0.0 110.233 177.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.521 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 25.7 mt-30 -55.42 -57.29 12.47 Favored 'General case' 0 C--N 1.346 0.443 0 C-N-CA 123.171 0.588 . . . . 0.0 112.132 -172.243 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.607 ' HG2' HG13 ' A' ' 45' ' ' VAL . 42.4 mtm-85 -44.64 -54.28 6.32 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-O 121.698 0.761 . . . . 0.0 109.896 177.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 59.7 m -65.63 -48.92 70.59 Favored 'General case' 0 N--CA 1.419 -2.004 0 CA-C-N 113.467 -1.697 . . . . 0.0 112.732 -172.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -66.54 -35.27 79.82 Favored 'General case' 0 C--N 1.314 -0.977 0 C-N-CA 124.169 0.988 . . . . 0.0 109.841 -175.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 30.4 mm -77.67 -44.53 29.17 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.303 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.769 176.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.15 -35.87 67.65 Favored 'General case' 0 CA--C 1.493 -1.239 0 CA-C-O 121.349 0.595 . . . . 0.0 109.558 -176.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 3.0 m -54.87 -42.77 72.47 Favored 'General case' 0 N--CA 1.394 -3.266 0 C-N-CA 126.017 1.727 . . . . 0.0 112.069 177.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.568 HD11 ' HE3' ' A' ' 99' ' ' LYS . 64.4 mt -83.7 -23.48 31.67 Favored 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -171.321 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.92 -26.46 68.32 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 122.046 0.927 . . . . 0.0 109.999 170.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -91.22 -36.15 14.1 Favored 'General case' 0 C--N 1.29 -1.984 0 CA-C-N 114.081 -1.418 . . . . 0.0 110.633 -173.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 93.5 m -47.35 139.32 6.57 Favored 'General case' 0 N--CA 1.409 -2.515 0 C-N-CA 125.086 1.354 . . . . 0.0 111.697 173.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.2 t -90.57 166.27 13.3 Favored 'General case' 0 N--CA 1.41 -2.444 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.001 -172.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.532 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP . 0.5 OUTLIER -119.23 166.43 12.99 Favored 'General case' 0 N--CA 1.413 -2.297 0 CA-C-N 115.018 -0.992 . . . . 0.0 113.443 -179.105 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.478 ' O ' HG21 ' A' ' 117' ' ' VAL . 32.7 mmm180 -139.07 138.72 37.36 Favored 'General case' 0 CA--C 1.489 -1.399 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 179.354 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -62.22 109.65 1.38 Allowed 'General case' 0 C--N 1.301 -1.513 0 CA-C-O 121.994 0.902 . . . . 0.0 113.227 -177.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 128.44 -16.86 5.92 Favored Glycine 0 N--CA 1.423 -2.177 0 CA-C-N 113.854 -1.521 . . . . 0.0 110.01 -174.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 39.2 t0 -73.16 155.58 39.48 Favored 'General case' 0 CA--C 1.502 -0.897 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 18.6 m -115.83 123.88 49.28 Favored 'General case' 0 C--N 1.28 -2.456 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 -177.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.532 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 15.9 m95 -112.97 162.36 15.95 Favored 'General case' 0 C--N 1.285 -2.198 0 N-CA-C 107.707 -1.22 . . . . 0.0 107.707 178.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.463 ' CD1' ' HA ' ' A' ' 94' ' ' THR . 52.2 m-85 -117.56 141.93 47.78 Favored 'General case' 0 C--N 1.274 -2.694 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.679 ' HA ' ' O ' ' A' ' 90' ' ' ILE 0.414 0.4 OUTLIER -106.36 132.05 52.85 Favored 'General case' 0 N--CA 1.424 -1.741 0 N-CA-C 114.385 1.254 . . . . 0.0 114.385 179.525 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.438 HG12 ' O ' ' A' ' 34' ' ' ASP . 89.9 t -110.49 151.21 12.74 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.485 0 CA-C-N 112.403 -2.18 . . . . 0.0 106.4 -176.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.499 ' OD1' ' HG2' ' A' ' 36' ' ' ARG . 18.7 t0 -72.91 131.69 42.53 Favored 'General case' 0 C--N 1.296 -1.723 0 N-CA-C 106.895 -1.521 . . . . 0.0 106.895 171.411 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.4 t -71.94 -22.7 61.43 Favored 'General case' 0 N--CA 1.422 -1.864 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 -171.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.564 HH11 ' HG2' ' A' ' 36' ' ' ARG . 9.3 mmt-85 -70.49 -36.91 74.08 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.413 -177.346 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.416 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 71.5 t90 -70.94 -43.19 68.67 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 178.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.521 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 41.3 t80 -61.29 -41.83 97.63 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.096 179.024 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.48 ' HA ' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -53.03 -45.58 68.06 Favored 'General case' 0 N--CA 1.425 -1.682 0 C-N-CA 122.426 0.29 . . . . 0.0 111.183 174.106 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.438 ' NE2' ' HD3' ' A' ' 43' ' ' LYS . 25.5 tp60 -64.09 -39.49 94.17 Favored 'General case' 0 N--CA 1.426 -1.661 0 C-N-CA 124.059 0.944 . . . . 0.0 110.74 179.039 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 65.6 t90 -61.35 -38.08 85.67 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.847 176.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.521 ' HG3' ' O ' ' A' ' 38' ' ' PHE . 33.1 mtmt -59.15 -41.06 87.45 Favored 'General case' 0 CA--C 1.5 -0.971 0 CA-C-O 120.712 0.291 . . . . 0.0 111.268 -179.049 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.537 ' HG2' ' OD2' ' A' ' 51' ' ' ASP . 18.5 mtpp -66.94 -36.58 82.55 Favored 'General case' 0 C--N 1.311 -1.109 0 CA-C-N 115.101 -0.954 . . . . 0.0 108.818 -176.416 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.634 ' O ' ' HA ' ' A' ' 55' ' ' MET . 0.1 OUTLIER -79.37 -36.46 39.22 Favored 'General case' 0 N--CA 1.436 -1.129 0 CA-C-N 114.504 -1.225 . . . . 0.0 111.876 -177.885 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.607 HG13 ' HG2' ' A' ' 13' ' ' ARG . 3.5 p -89.29 -18.63 7.75 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.087 0 O-C-N 121.973 -0.454 . . . . 0.0 111.896 -177.087 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.625 ' HA2' ' HB2' ' A' ' 52' ' ' LYS . . . 81.93 34.11 25.16 Favored Glycine 0 N--CA 1.428 -1.887 0 N-CA-C 111.924 -0.47 . . . . 0.0 111.924 -176.363 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.419 ' HB3' ' HB3' ' A' ' 42' ' ' LYS . 35.6 t80 -68.86 -42.43 77.08 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 123.055 0.542 . . . . 0.0 110.204 -179.341 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -86.96 126.43 34.71 Favored 'General case' 0 CA--C 1.498 -1.056 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 177.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.3 m -60.3 -36.26 77.47 Favored 'General case' 0 C--N 1.304 -1.38 0 CA-C-O 121.014 0.435 . . . . 0.0 112.079 -178.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 45.5 p90 -91.36 -7.67 50.2 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.586 -177.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.537 ' OD2' ' HG2' ' A' ' 43' ' ' LYS . 28.7 t70 -136.88 85.44 2.14 Favored 'General case' 0 CA--C 1.485 -1.552 0 CA-C-O 122.014 0.911 . . . . 0.0 110.439 -177.168 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.625 ' HB2' ' HA2' ' A' ' 46' ' ' GLY . 64.3 pttt -160.5 13.05 0.11 Allowed 'General case' 0 N--CA 1.432 -1.362 0 CA-C-N 113.73 -1.577 . . . . 0.0 112.768 -173.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 43.2 m-85 -68.64 -3.86 13.43 Favored 'General case' 0 C--N 1.287 -2.125 0 CA-C-O 121.932 0.872 . . . . 0.0 109.254 176.405 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.487 HE21 ' HE3' ' A' ' 43' ' ' LYS . 0.4 OUTLIER -112.45 17.34 19.38 Favored 'General case' 0 N--CA 1.403 -2.79 0 CA-C-N 114.887 -1.051 . . . . 0.0 109.47 -177.309 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . 0.634 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 51.6 ttp -62.83 105.11 0.62 Allowed 'General case' 0 N--CA 1.413 -2.289 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.561 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 74.99 29.31 60.94 Favored Glycine 0 N--CA 1.437 -1.269 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.124 -176.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -102.79 154.25 19.36 Favored 'General case' 0 N--CA 1.444 -0.732 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 -177.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 29.7 pt20 -83.27 -17.26 43.2 Favored 'General case' 0 C--N 1.301 -1.525 0 CA-C-O 121.709 0.766 . . . . 0.0 109.986 -177.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 28.0 m-80 -61.18 -24.01 66.0 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 114.784 -1.098 . . . . 0.0 111.959 179.05 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 22.2 m -117.61 -21.4 4.85 Favored 'Isoleucine or valine' 0 CA--C 1.457 -2.633 0 N-CA-C 113.094 0.776 . . . . 0.0 113.094 -176.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . 0.311 2.4 p90 -33.73 102.38 0.21 Allowed Pre-proline 0 CA--C 1.545 0.766 0 O-C-N 126.179 2.174 . . . . 0.0 114.901 -159.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -75.15 102.44 1.59 Allowed 'Trans proline' 0 N--CA 1.426 -2.469 0 C-N-CA 122.9 2.4 . . . . 0.0 110.384 176.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -73.42 -144.12 0.68 Allowed Glycine 0 C--N 1.28 -2.555 0 CA-C-N 114.078 -1.419 . . . . 0.0 112.624 176.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_exo -56.98 133.57 58.82 Favored 'Trans proline' 0 C--O 1.246 0.897 0 C-N-CA 122.926 2.417 . . . . 0.0 112.417 -177.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.534 HD11 ' HB3' ' A' ' 100' ' ' LEU . 54.8 mt -62.16 114.02 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.361 0 CA-C-N 114.966 -1.016 . . . . 0.0 110.47 -177.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.473 ' HB2' ' SD ' ' A' ' 107' ' ' MET . 7.9 t70 -97.98 113.94 25.93 Favored 'General case' 0 CA--C 1.489 -1.381 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 173.463 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.444 ' O ' HD23 ' A' ' 71' ' ' LEU . 13.6 m120 -89.85 -15.06 33.04 Favored 'General case' 0 C--N 1.286 -2.167 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.672 178.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 6.0 m -53.03 -18.2 1.91 Allowed 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 114.995 1.479 . . . . 0.0 114.995 -168.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -76.65 -3.01 77.87 Favored Glycine 0 CA--C 1.527 0.81 0 C-N-CA 120.932 -0.651 . . . . 0.0 113.107 -178.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.423 HD21 ' HA ' ' A' ' 34' ' ' ASP . 39.5 mt -107.44 -17.39 14.13 Favored 'General case' 0 C--O 1.243 0.734 0 CA-C-O 122.253 1.025 . . . . 0.0 109.335 -179.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.444 HD23 ' O ' ' A' ' 67' ' ' ASN . 2.7 mm? -84.01 163.8 19.71 Favored 'General case' 0 N--CA 1.401 -2.918 0 CA-C-N 113.679 -1.6 . . . . 0.0 112.198 -173.22 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.8 mttt -74.37 -176.23 2.61 Favored 'General case' 0 C--N 1.301 -1.51 0 CA-C-N 114.527 -1.215 . . . . 0.0 113.444 -178.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -84.98 35.3 0.57 Allowed 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 115.021 -0.991 . . . . 0.0 112.58 -173.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -166.43 -69.08 0.03 OUTLIER Glycine 0 N--CA 1.428 -1.845 0 C-N-CA 120.184 -1.007 . . . . 0.0 112.878 179.2 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -86.54 139.23 31.05 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-O 121.406 0.622 . . . . 0.0 111.742 -177.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -87.38 2.8 49.32 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.711 -179.264 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.712 ' HA ' HE21 ' A' ' 77' ' ' GLN . 0.0 OUTLIER -118.91 -1.2 11.05 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-O 121.809 0.814 . . . . 0.0 109.787 177.591 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 50.5 m -100.66 108.73 20.68 Favored 'General case' 0 C--N 1.281 -2.409 0 CA-C-N 114.407 -1.269 . . . . 0.0 111.137 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 87.1 mt -73.62 153.87 39.99 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.335 -178.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.443 ' HB2' ' CD1' ' A' ' 83' ' ' LEU . 98.9 mttt -78.78 165.83 23.13 Favored 'General case' 0 N--CA 1.426 -1.633 0 C-N-CA 119.734 -0.787 . . . . 0.0 109.202 170.579 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -82.46 -58.87 2.74 Favored 'General case' 0 C--N 1.285 -2.238 0 N-CA-C 113.799 1.037 . . . . 0.0 113.799 -171.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -74.96 12.57 0.83 Allowed 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 116.692 2.108 . . . . 0.0 116.692 -168.253 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.443 ' CD1' ' HB2' ' A' ' 80' ' ' LYS . 8.1 mp -73.78 169.11 18.04 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-O 121.547 0.689 . . . . 0.0 111.884 176.295 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.539 HG21 HD12 ' A' ' 87' ' ' LEU . 48.3 mt -137.33 166.88 24.19 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.575 0 N-CA-C 105.747 -1.945 . . . . 0.0 105.747 -178.013 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.572 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 65.9 t0 -56.24 -142.56 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.405 0 C-N-CA 126.498 1.919 . . . . 0.0 110.082 178.682 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.55 ' HA ' ' O ' ' A' ' 89' ' ' TYR . 7.5 pt-20 -39.09 -19.03 0.01 OUTLIER 'General case' 0 N--CA 1.533 3.694 0 N-CA-C 116.663 2.097 . . . . 0.0 116.663 -172.737 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.539 HD12 HG21 ' A' ' 84' ' ' ILE . 14.5 mt -67.87 -53.95 22.7 Favored 'General case' 0 C--N 1.281 -2.372 0 C-N-CA 123.891 0.876 . . . . 0.0 110.478 175.459 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -108.44 -30.85 8.08 Favored 'General case' 0 C--O 1.216 -0.667 0 CA-C-O 121.4 0.619 . . . . 0.0 110.993 -175.057 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . 0.572 ' CE1' ' HA ' ' A' ' 85' ' ' ASP . 8.7 p90 -142.32 -168.81 2.81 Favored 'General case' 0 C--O 1.173 -2.934 0 N-CA-C 104.738 -2.319 . . . . 0.0 104.738 177.542 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.679 ' O ' ' HA ' ' A' ' 32' ' ' LEU . 2.4 mt -144.7 141.07 23.7 Favored 'Isoleucine or valine' 0 CA--C 1.458 -2.578 0 CA-C-N 121.425 1.92 . . . . 0.0 109.47 173.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.502 ' CD2' ' HB3' ' A' ' 32' ' ' LEU . 77.9 mt -107.33 132.03 53.57 Favored 'General case' 0 C--N 1.274 -2.696 0 O-C-N 124.619 1.2 . . . . 0.0 110.792 176.739 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.401 HD12 ' N ' ' A' ' 92' ' ' LEU . 2.1 mp -141.67 156.65 66.15 Favored Pre-proline 0 C--N 1.276 -2.618 0 N-CA-C 106.8 -1.555 . . . . 0.0 106.8 -177.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.412 ' HD2' ' HB3' ' A' ' 19' ' ' LEU . 32.1 Cg_exo -61.23 167.77 8.77 Favored 'Trans proline' 0 C--O 1.26 1.578 0 C-N-CA 122.028 1.819 . . . . 0.0 110.218 174.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.463 ' HA ' ' CD1' ' A' ' 31' ' ' TYR . 32.4 m -49.86 -42.42 47.6 Favored 'General case' 0 C--N 1.306 -1.321 0 O-C-N 123.901 0.751 . . . . 0.0 110.231 176.527 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.492 ' O ' ' HG3' ' A' ' 99' ' ' LYS . 6.3 mm-40 -58.88 -50.34 74.39 Favored 'General case' 0 C--O 1.198 -1.609 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.89 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.581 ' O ' HD22 ' A' ' 100' ' ' LEU . . . -50.45 -58.11 9.49 Favored Glycine 0 CA--C 1.492 -1.362 0 O-C-N 124.153 0.908 . . . . 0.0 111.555 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 66.7 t-105 -54.65 -49.5 70.41 Favored 'General case' 0 C--N 1.311 -1.077 0 C-N-CA 123.169 0.588 . . . . 0.0 110.934 177.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -55.36 -31.11 61.5 Favored 'General case' 0 CA--C 1.496 -1.105 0 C-N-CA 123.088 0.555 . . . . 0.0 112.431 177.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.568 ' HE3' HD11 ' A' ' 19' ' ' LEU . 59.2 mttm -72.82 -51.4 19.04 Favored 'General case' 0 N--CA 1.411 -2.388 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 178.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.581 HD22 ' O ' ' A' ' 96' ' ' GLY . 0.6 OUTLIER -60.7 -39.25 87.83 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.426 0.632 . . . . 0.0 111.153 -179.563 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.551 ' HA ' ' HA ' ' A' ' 105' ' ' THR . 21.3 t -72.89 -28.14 26.32 Favored 'Isoleucine or valine' 0 N--CA 1.403 -2.823 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.774 177.514 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 18.6 t -76.04 -35.45 59.46 Favored 'General case' 0 C--N 1.297 -1.696 0 O-C-N 121.228 -0.92 . . . . 0.0 109.101 178.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' TRP . . . . . 0.54 ' CZ2' ' HB3' ' A' ' 99' ' ' LYS . 28.2 m0 -80.66 -48.44 12.61 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.02 -175.371 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -126.02 -2.14 7.1 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 114.185 1.18 . . . . 0.0 114.185 -177.118 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.551 ' HA ' ' HA ' ' A' ' 101' ' ' VAL 0.351 14.3 t 52.74 175.1 0.02 OUTLIER 'General case' 0 CA--C 1.509 -0.596 0 CA-C-O 123.688 1.708 . . . . 0.0 115.135 -175.59 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 54.4 tp -95.82 160.36 14.51 Favored 'General case' 1 C--N 1.231 -4.553 0 CA-C-N 111.941 -2.39 . . . . 0.0 107.072 -178.023 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.525 ' HG3' ' O ' ' A' ' 65' ' ' ILE . 37.3 mtp -68.62 155.67 39.58 Favored 'General case' 0 CA--C 1.487 -1.479 0 C-N-CA 119.045 -1.062 . . . . 0.0 108.811 175.311 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -84.43 132.53 34.56 Favored 'General case' 0 C--N 1.258 -3.379 0 CA-C-N 115.446 -0.797 . . . . 0.0 113.059 177.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 111.68 -37.37 3.72 Favored Glycine 0 N--CA 1.397 -3.908 0 CA-C-N 114.068 -1.424 . . . . 0.0 110.875 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -93.38 159.69 15.14 Favored 'General case' 0 N--CA 1.422 -1.857 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 178.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . 0.53 ' HB2' ' OE1' ' A' ' 77' ' ' GLN . 45.3 mt-10 -131.65 154.13 81.73 Favored Pre-proline 0 C--N 1.285 -2.223 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 -177.137 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -54.04 142.43 65.46 Favored 'Trans proline' 0 CA--C 1.458 -3.321 0 C-N-CA 124.13 3.22 . . . . 0.0 114.521 -175.264 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.477 ' O ' HD23 ' A' ' 32' ' ' LEU . 2.7 mp -100.51 113.8 37.38 Favored 'Isoleucine or valine' 1 N--CA 1.367 -4.604 0 CA-C-N 113.844 -1.526 . . . . 0.0 107.267 175.035 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -100.09 139.51 35.65 Favored 'General case' 0 C--N 1.281 -2.391 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.745 176.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.44 ' HB2' HD22 ' A' ' 32' ' ' LEU . 19.2 tpt180 -134.09 129.3 35.79 Favored 'General case' 0 C--N 1.293 -1.876 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 -177.682 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -79.58 163.29 24.76 Favored 'General case' 0 C--N 1.28 -2.435 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.677 177.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.478 HG21 ' O ' ' A' ' 25' ' ' ARG . 57.4 t -57.41 153.94 2.36 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.09 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.797 175.521 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 25.0 m -48.68 138.07 4.0 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.405 0 C-N-CA 125.228 1.411 . . . . 0.0 113.688 -176.191 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -87.77 -7.88 56.74 Favored 'General case' 0 C--N 1.275 -2.657 0 CA-C-N 112.635 -2.075 . . . . 0.0 109.776 -174.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 . . . . . 0 C--N 1.291 -1.955 0 CA-C-N 114.404 -1.271 . . . . 0.0 110.128 175.334 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.6 mmm . . . . . 0 CA--C 1.5 -0.943 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 69.66 147.48 0.07 Allowed 'General case' 0 C--O 1.243 0.744 0 C-N-CA 125.435 1.494 . . . . 0.0 113.401 178.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -87.87 138.64 31.28 Favored 'General case' 0 N--CA 1.416 -2.154 0 N-CA-C 107.322 -1.362 . . . . 0.0 107.322 175.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -166.87 45.99 0.26 Allowed Glycine 0 N--CA 1.437 -1.249 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.548 179.173 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.507 ' O ' ' HA ' ' A' ' 103' ' ' TRP . . . -171.34 23.99 0.09 OUTLIER Glycine 0 C--O 1.224 -0.511 0 C-N-CA 120.203 -0.998 . . . . 0.0 113.314 178.498 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.488 ' HA ' ' CD1' ' A' ' 103' ' ' TRP . . . -121.64 177.37 5.27 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 113.491 0.923 . . . . 0.0 113.491 -175.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.545 ' HB3' ' HG2' ' A' ' 12' ' ' GLN . . . -87.11 -177.13 5.94 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-N 114.336 -1.302 . . . . 0.0 109.489 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.649 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 9.8 t70 -71.32 140.36 50.24 Favored 'General case' 0 N--CA 1.427 -1.582 0 N-CA-C 106.746 -1.575 . . . . 0.0 106.746 173.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 65.0 mt -54.29 -40.79 68.22 Favored 'General case' 0 C--N 1.305 -1.353 0 CA-C-O 121.232 0.539 . . . . 0.0 110.482 -179.112 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -65.12 -39.9 93.74 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 114.318 -1.31 . . . . 0.0 110.033 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.422 ' HB ' ' HB3' ' A' ' 8' ' ' ASP . 2.3 m -66.75 -49.53 65.67 Favored 'General case' 0 N--CA 1.401 -2.877 0 CA-C-N 114.829 -1.078 . . . . 0.0 109.578 179.663 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.649 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 23.9 mt-30 -56.35 -44.87 80.52 Favored 'General case' 0 CA--C 1.474 -1.957 0 CA-C-N 114.914 -1.039 . . . . 0.0 111.225 -179.052 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.967 ' HD3' HG21 ' A' ' 45' ' ' VAL 0.268 10.3 mmm180 -69.56 -30.77 68.65 Favored 'General case' 0 N--CA 1.405 -2.685 0 N-CA-C 115.092 1.516 . . . . 0.0 115.092 -177.193 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.8 t -78.92 -46.21 18.89 Favored 'General case' 0 C--N 1.261 -3.279 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 179.831 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.519 ' O ' ' HB ' ' A' ' 18' ' ' THR . 11.1 t0 -59.83 -48.15 82.86 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 124.016 0.926 . . . . 0.0 109.624 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.621 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 12.4 mm -72.5 -39.07 61.56 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.207 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.611 -177.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.52 ' O ' ' HG2' ' A' ' 21' ' ' LYS . . . -57.94 -35.11 70.66 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 177.657 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.59 ' HA ' ' HE2' ' A' ' 21' ' ' LYS . 1.8 m -64.94 -43.39 92.89 Favored 'General case' 0 N--CA 1.399 -2.986 0 CA-C-N 114.183 -1.372 . . . . 0.0 111.786 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.554 ' HB3' ' CG ' ' A' ' 93' ' ' PRO . 88.8 mt -75.31 -12.87 60.36 Favored 'General case' 0 C--N 1.268 -2.955 0 N-CA-C 113.207 0.817 . . . . 0.0 113.207 -175.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.621 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 17.5 mt -86.22 -29.17 23.37 Favored 'General case' 0 C--N 1.309 -1.185 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 176.283 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.59 ' HE2' ' HA ' ' A' ' 18' ' ' THR . 54.4 pttt -96.32 -18.75 19.75 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-N 115.516 -0.766 . . . . 0.0 111.511 -175.186 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.6 m -53.46 131.71 38.61 Favored 'General case' 0 N--CA 1.399 -3.005 0 CA-C-O 122.251 1.024 . . . . 0.0 111.254 170.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 59.5 m -65.67 141.24 58.44 Favored 'General case' 0 N--CA 1.406 -2.634 0 CA-C-N 113.355 -1.748 . . . . 0.0 112.527 -178.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.412 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP . 0.4 OUTLIER -112.13 159.88 18.09 Favored 'General case' 0 N--CA 1.41 -2.455 0 CA-C-N 114.948 -1.023 . . . . 0.0 112.738 179.864 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 28.3 mmt85 -130.86 144.69 51.64 Favored 'General case' 0 C--N 1.288 -2.082 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.365 -177.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 18.0 pttm -66.12 97.03 0.35 Allowed 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 122.213 1.006 . . . . 0.0 109.56 177.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 147.43 -17.44 1.49 Allowed Glycine 0 N--CA 1.427 -1.909 0 CA-C-N 113.636 -1.62 . . . . 0.0 109.965 -172.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -77.42 145.65 37.04 Favored 'General case' 0 CA--C 1.499 -0.986 0 CA-C-O 120.855 0.36 . . . . 0.0 110.113 177.324 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.402 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 58.8 m -104.44 132.71 50.38 Favored 'General case' 0 C--N 1.293 -1.877 0 N-CA-C 107.518 -1.289 . . . . 0.0 107.518 176.172 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.412 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 22.6 m95 -121.83 143.8 49.2 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 -178.9 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.44 ' HB2' ' HB2' ' A' ' 97' ' ' TRP . 57.6 m-85 -107.04 141.03 38.92 Favored 'General case' 0 C--N 1.28 -2.452 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.842 -174.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.51 ' HA ' ' O ' ' A' ' 90' ' ' ILE . 5.9 mp -93.21 135.64 34.22 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 122.048 0.927 . . . . 0.0 112.799 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.501 HG23 HD23 ' A' ' 92' ' ' LEU . 73.7 t -116.14 136.8 51.94 Favored 'Isoleucine or valine' 0 C--N 1.28 -2.45 0 N-CA-C 105.776 -1.935 . . . . 0.0 105.776 171.478 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.523 ' OD1' ' HG2' ' A' ' 36' ' ' ARG . 19.7 t0 -63.19 126.94 29.06 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 169.008 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.566 ' OG ' ' HE3' ' A' ' 39' ' ' LYS . 48.4 t -67.88 -23.86 65.17 Favored 'General case' 0 C--N 1.287 -2.15 0 CA-C-N 115.311 -0.858 . . . . 0.0 109.831 -171.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.523 ' HG2' ' OD1' ' A' ' 34' ' ' ASP . 17.3 mmt-85 -62.24 -40.68 96.98 Favored 'General case' 0 C--O 1.239 0.52 0 N-CA-C 109.603 -0.518 . . . . 0.0 109.603 -178.168 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.454 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 51.4 t90 -68.34 -45.52 72.65 Favored 'General case' 0 C--O 1.227 -0.094 0 CA-C-N 115.304 -0.862 . . . . 0.0 108.784 179.197 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.519 ' CG ' HD12 ' A' ' 90' ' ' ILE . 17.8 t80 -65.65 -34.56 78.51 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.984 -177.06 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.566 ' HE3' ' OG ' ' A' ' 35' ' ' SER . 96.7 mttt -68.51 -32.73 72.89 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-O 120.707 0.289 . . . . 0.0 111.438 176.395 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.454 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 20.1 tp60 -67.66 -41.61 83.5 Favored 'General case' 0 N--CA 1.412 -2.346 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 174.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.667 ' O ' HG22 ' A' ' 45' ' ' VAL . 52.8 t90 -65.67 -40.37 92.33 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 114.902 -1.044 . . . . 0.0 110.121 178.384 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.435 ' HD3' ' HA ' ' A' ' 39' ' ' LYS . 13.4 mtpp -52.06 -43.36 63.78 Favored 'General case' 0 C--O 1.216 -0.697 0 C-N-CA 124.408 1.083 . . . . 0.0 113.398 178.291 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 45.7 mttm -74.7 -40.89 61.07 Favored 'General case' 0 C--N 1.303 -1.422 0 C-N-CA 119.809 -0.756 . . . . 0.0 111.207 179.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.57 ' HB2' HG23 ' A' ' 60' ' ' VAL . 4.2 t80 -55.81 -33.92 64.88 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-N 114.389 -1.278 . . . . 0.0 111.933 179.752 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.967 HG21 ' HD3' ' A' ' 13' ' ' ARG . 3.4 m -94.41 -23.54 5.18 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.826 0 N-CA-C 112.608 0.595 . . . . 0.0 112.608 176.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.567 ' CA ' ' HG3' ' A' ' 52' ' ' LYS . . . 81.83 38.82 12.85 Favored Glycine 1 N--CA 1.391 -4.339 0 C-N-CA 120.033 -1.079 . . . . 0.0 110.498 -172.887 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.524 ' HB2' ' HE ' ' A' ' 13' ' ' ARG . 42.4 t80 -59.66 -49.4 77.89 Favored 'General case' 0 N--CA 1.433 -1.289 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 176.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -73.22 114.47 11.44 Favored 'General case' 0 N--CA 1.429 -1.519 0 CA-C-N 113.651 -1.613 . . . . 0.0 108.263 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 5.7 m -55.56 -27.44 49.09 Favored 'General case' 0 C--N 1.3 -1.571 0 C-N-CA 124.885 1.274 . . . . 0.0 113.206 -175.099 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 44.1 p90 -94.88 -0.91 53.61 Favored 'General case' 0 C--N 1.298 -1.661 0 O-C-N 122.153 -0.342 . . . . 0.0 111.097 -178.135 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -136.34 77.07 1.63 Allowed 'General case' 0 C--N 1.312 -1.028 0 C-N-CA 119.502 -0.879 . . . . 0.0 110.76 -173.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.567 ' HG3' ' CA ' ' A' ' 46' ' ' GLY . 0.0 OUTLIER -118.21 23.09 11.81 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-O 121.809 0.814 . . . . 0.0 111.523 177.029 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 74.4 m-85 -77.87 -22.59 49.56 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 176.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.463 ' HB3' HG11 ' A' ' 60' ' ' VAL . 11.1 mm100 -95.57 -0.68 51.71 Favored 'General case' 0 N--CA 1.419 -2.02 0 C-N-CA 124.733 1.213 . . . . 0.0 110.283 -179.02 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 53.4 ttp -66.18 115.72 6.48 Favored 'General case' 0 N--CA 1.419 -1.994 0 CA-C-O 121.34 0.59 . . . . 0.0 110.672 -176.184 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 79.15 12.73 83.7 Favored Glycine 0 N--CA 1.437 -1.285 0 CA-C-N 115.065 -0.971 . . . . 0.0 111.512 -179.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.615 ' HB3' HG22 ' A' ' 60' ' ' VAL . 5.4 t70 -87.06 146.4 26.1 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 -177.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.447 ' O ' ' HD2' ' A' ' 61' ' ' TYR . 4.6 pt20 -83.82 -21.51 32.07 Favored 'General case' 0 C--N 1.285 -2.211 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.827 -177.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -65.46 -22.86 66.8 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 121.654 0.74 . . . . 0.0 111.859 178.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.615 HG22 ' HB3' ' A' ' 57' ' ' ASP . 32.0 m -116.84 2.66 7.66 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.186 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.449 -173.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.447 ' HD2' ' O ' ' A' ' 58' ' ' GLN . 0.3 OUTLIER -68.78 118.32 59.68 Favored Pre-proline 0 C--N 1.313 -1.02 0 C-N-CA 120.115 -0.634 . . . . 0.0 109.969 -179.22 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -92.09 117.74 0.44 Allowed 'Trans proline' 0 N--CA 1.407 -3.563 0 C-N-CA 122.357 2.038 . . . . 0.0 110.455 176.103 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -74.54 -141.17 0.69 Allowed Glycine 0 C--N 1.268 -3.226 0 CA-C-N 114.158 -1.383 . . . . 0.0 111.949 175.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.523 ' HA ' ' O ' ' A' ' 104' ' ' TYR . 50.6 Cg_exo -53.69 131.56 44.65 Favored 'Trans proline' 0 C--O 1.251 1.133 0 C-N-CA 122.881 2.387 . . . . 0.0 113.041 -178.024 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 67.9 mt -60.99 122.76 12.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.381 -178.059 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -117.56 127.54 54.08 Favored 'General case' 0 C--N 1.297 -1.676 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.312 -179.574 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.477 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 93.5 m-20 -112.58 10.69 19.55 Favored 'General case' 0 C--N 1.301 -1.5 0 O-C-N 123.83 0.707 . . . . 0.0 111.104 -178.484 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 50.9 m -88.2 78.43 8.08 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 122.22 1.01 . . . . 0.0 111.621 -177.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 174.02 -37.77 0.12 Allowed Glycine 0 CA--C 1.48 -2.145 0 N-CA-C 104.91 -3.276 . . . . 0.0 104.91 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.486 HD11 ' HB3' ' A' ' 89' ' ' TYR . 28.8 tp -70.18 -45.6 66.37 Favored 'General case' 1 N--CA 1.374 -4.226 0 CA-C-N 112.221 -1.989 . . . . 0.0 107.769 168.866 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.541 ' O ' ' HE3' ' A' ' 80' ' ' LYS . 75.3 mt -71.05 159.75 34.16 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 114.643 -1.162 . . . . 0.0 109.64 175.254 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.401 ' HG2' ' HG2' ' A' ' 80' ' ' LYS . 41.8 mtpt -74.51 -170.51 1.03 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.776 0.322 . . . . 0.0 111.224 -178.328 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -76.23 96.58 3.95 Favored 'General case' 0 CA--C 1.494 -1.177 0 CA-C-O 121.285 0.564 . . . . 0.0 111.07 -178.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 92.08 -175.55 38.24 Favored Glycine 0 N--CA 1.418 -2.501 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.275 179.335 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.496 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 17.1 t0 72.16 -49.49 0.69 Allowed 'General case' 0 N--CA 1.499 2.004 0 C-N-CA 126.395 1.878 . . . . 0.0 113.255 179.05 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.435 ' HA ' HD13 ' A' ' 71' ' ' LEU . . . 62.86 24.02 14.32 Favored 'General case' 0 C--N 1.262 -3.203 0 C-N-CA 127.846 2.458 . . . . 0.0 111.69 -177.616 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.496 ' HG2' ' O ' ' A' ' 75' ' ' ASP . 10.7 mm-40 -130.02 2.78 4.81 Favored 'General case' 0 C--N 1.291 -1.937 0 N-CA-C 105.95 -1.87 . . . . 0.0 105.95 179.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.5 p -105.51 123.29 47.64 Favored 'General case' 0 C--N 1.293 -1.874 0 CA-C-N 114.107 -1.406 . . . . 0.0 113.074 -171.119 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.414 HD11 HG21 ' A' ' 113' ' ' ILE . 71.5 mt -93.72 138.54 31.82 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-O 120.736 0.303 . . . . 0.0 110.381 175.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.541 ' HE3' ' O ' ' A' ' 71' ' ' LEU . 99.1 mttt -72.35 139.87 48.15 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-O 121.32 0.581 . . . . 0.0 110.753 176.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -65.42 -18.17 65.1 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 122.011 0.91 . . . . 0.0 110.597 176.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 8.8 t-80 -82.82 -7.16 59.68 Favored 'General case' 0 C--N 1.296 -1.728 0 CA-C-N 114.169 -1.378 . . . . 0.0 110.676 -175.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.467 ' HG ' ' HB2' ' A' ' 80' ' ' LYS . 77.2 mt -76.35 130.48 38.14 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-O 121.148 0.499 . . . . 0.0 112.039 -175.613 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.675 HG21 HD12 ' A' ' 87' ' ' LEU . 50.9 mt -112.39 -179.37 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.29 -2.002 0 N-CA-C 105.645 -1.983 . . . . 0.0 105.645 173.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.651 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 13.0 t70 -63.83 -145.14 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.344 0 C-N-CA 124.737 1.215 . . . . 0.0 110.139 -179.342 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.593 ' HA ' ' O ' ' A' ' 89' ' ' TYR 0.254 0.0 OUTLIER -40.63 -17.69 0.01 OUTLIER 'General case' 0 N--CA 1.52 3.036 0 N-CA-C 117.006 2.225 . . . . 0.0 117.006 -175.147 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.675 HD12 HG21 ' A' ' 84' ' ' ILE . 43.4 mt -59.03 -52.48 65.56 Favored 'General case' 0 C--N 1.277 -2.579 0 C-N-CA 123.471 0.708 . . . . 0.0 109.782 170.526 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -112.59 -40.5 4.06 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.987 -176.439 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . 0.651 ' CE1' ' HA ' ' A' ' 85' ' ' ASP . 0.8 OUTLIER -135.74 178.43 7.05 Favored 'General case' 0 C--O 1.17 -3.097 0 C-N-CA 119.84 -0.744 . . . . 0.0 109.606 -179.983 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.519 HD12 ' CG ' ' A' ' 38' ' ' PHE . 6.8 mt -139.45 147.98 23.81 Favored 'Isoleucine or valine' 0 N--CA 1.404 -2.735 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 174.612 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.465 ' HA ' HD23 ' A' ' 91' ' ' LEU . 64.4 mt -109.72 129.54 55.6 Favored 'General case' 0 N--CA 1.399 -3.015 0 O-C-N 124.623 1.202 . . . . 0.0 111.008 178.026 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.501 HD23 HG23 ' A' ' 33' ' ' VAL . 1.5 mm? -123.43 150.03 59.74 Favored Pre-proline 0 C--N 1.27 -2.86 0 CA-C-N 113.419 -1.719 . . . . 0.0 106.47 -177.26 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.554 ' CG ' ' HB3' ' A' ' 19' ' ' LEU . 10.2 Cg_endo -64.95 168.34 13.94 Favored 'Trans proline' 0 N--CA 1.428 -2.332 0 N-CA-C 108.296 -1.463 . . . . 0.0 108.296 169.193 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 18.9 m -43.7 -48.12 7.88 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 123.667 0.604 . . . . 0.0 110.732 173.092 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -68.16 -36.39 79.55 Favored 'General case' 0 CA--C 1.485 -1.553 0 CA-C-N 115.509 -0.769 . . . . 0.0 112.401 -178.365 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -58.88 -57.89 17.45 Favored Glycine 0 N--CA 1.417 -2.632 0 N-CA-C 110.168 -1.173 . . . . 0.0 110.168 179.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.44 ' HB2' ' HB2' ' A' ' 31' ' ' TYR . 70.0 t-105 -54.63 -50.57 67.8 Favored 'General case' 0 N--CA 1.421 -1.893 0 C-N-CA 123.449 0.7 . . . . 0.0 110.611 174.822 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -50.59 -34.48 26.06 Favored 'General case' 0 C--O 1.215 -0.748 0 C-N-CA 123.029 0.532 . . . . 0.0 112.31 177.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 41.7 mttm -70.71 -50.02 40.79 Favored 'General case' 0 CA--C 1.456 -2.644 0 CA-C-O 120.862 0.363 . . . . 0.0 110.375 179.447 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.539 HD23 ' CE3' ' A' ' 103' ' ' TRP . 44.3 mt -65.64 -31.2 72.09 Favored 'General case' 0 C--N 1.264 -3.133 0 CA-C-N 115.078 -0.964 . . . . 0.0 111.804 -176.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.536 ' HA ' ' HA ' ' A' ' 105' ' ' THR . 12.7 t -81.06 -24.77 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.402 -2.847 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.319 174.752 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 37.6 t -76.35 -36.44 58.19 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 107.519 -1.289 . . . . 0.0 107.519 177.522 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' TRP . . . . . 0.539 ' CE3' HD23 ' A' ' 100' ' ' LEU . 50.0 m0 -80.9 -53.84 6.1 Favored 'General case' 0 N--CA 1.41 -2.445 0 CA-C-N 114.677 -1.147 . . . . 0.0 112.08 -177.16 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' TYR . . . . . 0.523 ' O ' ' HA ' ' A' ' 64' ' ' PRO . 41.6 m-85 -120.85 -3.38 9.7 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.521 -0.471 . . . . 0.0 112.187 -170.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.536 ' HA ' ' HA ' ' A' ' 101' ' ' VAL 0.265 7.2 t 50.02 -173.46 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.17 0 C-N-CA 126.591 1.956 . . . . 0.0 114.376 -174.132 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 44.9 tp -114.98 144.31 43.8 Favored 'General case' 0 C--N 1.256 -3.483 0 CA-C-N 113.578 -1.646 . . . . 0.0 109.458 -175.347 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.506 ' SD ' ' HB2' ' A' ' 64' ' ' PRO . 65.2 mmm -65.33 156.64 31.47 Favored 'General case' 0 C--O 1.247 0.958 0 CA-C-O 121.584 0.707 . . . . 0.0 110.928 176.682 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -79.83 138.04 37.11 Favored 'General case' 0 C--N 1.278 -2.541 0 CA-C-N 114.77 -1.105 . . . . 0.0 111.951 -176.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 101.63 -37.21 3.75 Favored Glycine 0 N--CA 1.415 -2.762 0 CA-C-N 114.754 -1.112 . . . . 0.0 110.384 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 24.5 mp0 -74.97 158.15 33.76 Favored 'General case' 0 CA--C 1.499 -0.991 0 CA-C-O 121.679 0.752 . . . . 0.0 112.043 178.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -116.83 157.57 45.96 Favored Pre-proline 0 N--CA 1.408 -2.536 0 N-CA-C 105.364 -2.087 . . . . 0.0 105.364 175.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . 0.433 ' HB3' ' CE2' ' A' ' 97' ' ' TRP . 13.8 Cg_exo -73.63 122.32 7.74 Favored 'Trans proline' 0 CA--C 1.451 -3.651 0 N-CA-C 108.047 -1.559 . . . . 0.0 108.047 166.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.414 HG21 HD11 ' A' ' 79' ' ' LEU . 3.6 mp -83.01 106.96 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.38 -3.956 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 -179.42 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.406 ' O ' ' HD3' ' A' ' 115' ' ' ARG . . . -103.5 129.46 50.68 Favored 'General case' 0 N--CA 1.402 -2.841 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.861 -179.141 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.406 ' HD3' ' O ' ' A' ' 114' ' ' ALA . 21.9 mmt180 -131.23 -172.51 2.86 Favored 'General case' 0 C--N 1.286 -2.154 0 N-CA-C 105.475 -2.046 . . . . 0.0 105.475 177.787 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -130.11 176.35 8.16 Favored 'General case' 0 C--N 1.269 -2.911 0 C-N-CA 118.575 -1.25 . . . . 0.0 111.46 -177.561 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 61.6 t -63.1 141.42 18.15 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.118 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 173.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 25.5 m -82.79 164.42 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.39 -3.454 0 CA-C-O 121.823 0.82 . . . . 0.0 112.463 -173.363 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -68.0 -12.09 60.12 Favored 'General case' 0 C--N 1.301 -1.52 0 CA-C-N 113.431 -1.713 . . . . 0.0 112.004 -179.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 11.9 mm100 . . . . . 0 C--N 1.309 -1.16 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 -179.254 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.234 0.273 0 N-CA-C 106.526 -1.657 . . . . 0.0 106.526 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -72.32 166.59 22.18 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -172.347 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.421 ' O ' HD23 ' A' ' 9' ' ' LEU . 10.3 mp0 -66.66 120.62 13.77 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 114.328 -1.305 . . . . 0.0 108.893 178.08 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -143.27 -177.01 17.86 Favored Glycine 0 N--CA 1.415 -2.761 0 C-N-CA 120.176 -1.011 . . . . 0.0 112.892 -179.201 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 166.52 103.37 0.17 Allowed Glycine 0 CA--C 1.477 -2.31 0 N-CA-C 106.326 -2.71 . . . . 0.0 106.326 -179.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.471 ' HB1' ' CD1' ' A' ' 103' ' ' TRP . . . 66.24 64.42 0.52 Allowed 'General case' 0 CA--C 1.499 -0.998 0 N-CA-C 105.088 -2.189 . . . . 0.0 105.088 -168.279 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.458 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . 73.52 155.34 0.16 Allowed 'General case' 0 CA--C 1.499 -0.989 0 CA-C-N 112.138 -2.301 . . . . 0.0 110.207 -172.346 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.577 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 4.8 p-10 -84.46 153.54 23.29 Favored 'General case' 0 CA--C 1.455 -2.708 0 C-N-CA 118.988 -1.085 . . . . 0.0 109.324 173.598 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.484 ' O ' ' HG3' ' A' ' 13' ' ' ARG . 3.9 mm? -47.5 -46.16 27.01 Favored 'General case' 0 C--N 1.286 -2.19 0 C-N-CA 125.757 1.623 . . . . 0.0 112.1 -178.695 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -67.78 -36.66 80.85 Favored 'General case' 0 C--N 1.257 -3.419 0 CA-C-N 113.064 -1.88 . . . . 0.0 110.273 -177.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.458 ' CG2' ' HB1' ' A' ' 7' ' ' ALA . 1.7 m -67.82 -50.21 58.02 Favored 'General case' 0 N--CA 1.395 -3.189 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.393 176.676 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.577 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 87.8 mt-30 -50.92 -53.4 33.15 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 124.0 0.812 . . . . 0.0 111.387 -175.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.651 ' HG2' HG13 ' A' ' 45' ' ' VAL . 28.9 mtm180 -48.56 -60.04 3.02 Favored 'General case' 0 N--CA 1.487 1.416 0 CA-C-O 122.137 0.97 . . . . 0.0 110.676 176.777 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.9 m -65.26 -43.51 91.08 Favored 'General case' 0 N--CA 1.424 -1.727 0 CA-C-N 113.379 -1.737 . . . . 0.0 113.091 -171.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -68.22 -36.08 78.97 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.451 -176.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.511 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 22.9 mm -78.79 -37.77 20.65 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.158 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.248 177.253 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.2 -43.23 92.24 Favored 'General case' 0 CA--C 1.492 -1.279 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 179.689 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.41 ' O ' ' HB ' ' A' ' 22' ' ' THR . 2.3 m -55.43 -39.98 70.94 Favored 'General case' 0 N--CA 1.403 -2.775 0 C-N-CA 125.504 1.522 . . . . 0.0 111.543 178.189 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 78.5 mt -84.29 -13.89 51.25 Favored 'General case' 0 C--N 1.295 -1.799 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -174.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 59.7 mt -81.58 -17.54 47.97 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 175.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -104.01 -41.44 5.85 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.156 -1.384 . . . . 0.0 111.424 -175.035 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.41 ' HB ' ' O ' ' A' ' 18' ' ' THR . 1.4 t -46.31 167.29 0.02 OUTLIER 'General case' 0 C--O 1.242 0.702 0 C-N-CA 126.35 1.86 . . . . 0.0 114.81 -179.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 61.5 m -61.25 127.06 29.68 Favored 'General case' 0 N--CA 1.389 -3.502 0 CA-C-N 111.697 -2.501 . . . . 0.0 112.286 179.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.546 ' HB3' ' CZ2' ' A' ' 30' ' ' TRP . 0.3 OUTLIER -111.7 -18.49 12.75 Favored 'General case' 0 C--N 1.283 -2.289 0 CA-C-N 113.797 -1.547 . . . . 0.0 113.116 -177.969 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.626 ' O ' HG11 ' A' ' 117' ' ' VAL . 9.9 mtm180 60.17 -152.67 0.39 Allowed 'General case' 0 C--N 1.253 -3.627 0 CA-C-N 112.838 -1.983 . . . . 0.0 109.09 -178.314 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 57.7 mtmt -126.43 29.02 5.85 Favored 'General case' 0 C--N 1.292 -1.91 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 172.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -153.3 33.33 0.78 Allowed Glycine 0 N--CA 1.435 -1.368 0 CA-C-N 114.33 -1.305 . . . . 0.0 113.074 -179.084 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.48 ' H ' HG23 ' A' ' 117' ' ' VAL . 7.9 t70 -109.56 173.45 6.32 Favored 'General case' 0 N--CA 1.484 1.264 0 N-CA-C 106.954 -1.498 . . . . 0.0 106.954 177.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.406 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 85.9 m -122.19 121.19 36.27 Favored 'General case' 0 C--N 1.282 -2.331 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.546 ' CZ2' ' HB3' ' A' ' 24' ' ' LEU . 17.4 m95 -103.31 126.74 50.63 Favored 'General case' 0 N--CA 1.388 -3.564 0 CA-C-N 114.662 -1.153 . . . . 0.0 109.388 -179.249 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.446 ' HB2' ' HB2' ' A' ' 97' ' ' TRP . 82.8 m-85 -98.38 144.47 27.72 Favored 'General case' 0 C--N 1.272 -2.782 0 CA-C-N 115.065 -0.971 . . . . 0.0 110.975 -175.567 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.55 ' CD1' HD21 ' A' ' 91' ' ' LEU . 6.1 mp -93.5 141.9 27.95 Favored 'General case' 0 N--CA 1.426 -1.665 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.971 -177.254 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.547 ' CG1' ' HB ' ' A' ' 90' ' ' ILE . 0.6 OUTLIER -133.11 142.24 42.62 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.756 0 CA-C-N 114.377 -1.283 . . . . 0.0 108.365 174.963 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.482 ' OD1' ' HB2' ' A' ' 36' ' ' ARG . 10.5 t70 -61.13 128.98 39.08 Favored 'General case' 0 C--N 1.305 -1.349 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 176.205 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.507 ' O ' ' HD3' ' A' ' 39' ' ' LYS . 19.5 p -61.58 -34.86 76.33 Favored 'General case' 0 C--O 1.209 -1.028 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 -173.721 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.482 ' HB2' ' OD1' ' A' ' 34' ' ' ASP . 0.0 OUTLIER -64.13 -36.7 84.88 Favored 'General case' 0 CA--C 1.482 -1.667 0 CA-C-O 121.23 0.538 . . . . 0.0 111.204 -176.564 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.509 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 51.1 t90 -63.32 -44.04 96.08 Favored 'General case' 0 C--N 1.287 -2.131 0 CA-C-N 113.992 -1.458 . . . . 0.0 108.266 178.164 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -69.64 -43.17 73.17 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.829 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.507 ' HD3' ' O ' ' A' ' 35' ' ' SER . 14.6 mptt -55.38 -32.74 62.86 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 122.601 0.361 . . . . 0.0 111.937 171.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.509 ' HB3' ' O ' ' A' ' 37' ' ' TRP . 62.6 tp60 -72.32 -46.62 54.82 Favored 'General case' 0 N--CA 1.419 -2.016 0 C-N-CA 123.22 0.608 . . . . 0.0 109.464 176.727 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 72.6 t90 -58.4 -39.22 79.11 Favored 'General case' 0 C--O 1.213 -0.821 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.871 177.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.517 ' HG2' ' CD1' ' A' ' 47' ' ' PHE . 15.3 mtpp -56.39 -40.0 73.89 Favored 'General case' 0 N--CA 1.44 -0.942 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.428 ' HB3' ' HG3' ' A' ' 54' ' ' GLN . 39.6 mttp -72.31 -44.67 62.37 Favored 'General case' 0 C--N 1.293 -1.87 0 CA-C-O 121.133 0.492 . . . . 0.0 110.25 177.478 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.688 ' HB2' HG23 ' A' ' 60' ' ' VAL . 1.0 OUTLIER -58.12 -39.1 77.83 Favored 'General case' 0 N--CA 1.418 -2.072 0 CA-C-N 114.524 -1.217 . . . . 0.0 110.948 -179.226 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.651 HG13 ' HG2' ' A' ' 13' ' ' ARG . 2.6 p -92.25 -23.62 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.387 -3.615 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -175.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.562 ' HA2' ' HG3' ' A' ' 52' ' ' LYS . . . 93.07 22.85 26.54 Favored Glycine 0 N--CA 1.433 -1.535 0 C-N-CA 120.077 -1.059 . . . . 0.0 111.14 -175.249 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.545 ' HB2' ' CG1' ' A' ' 45' ' ' VAL . 20.1 t80 -78.87 -30.81 45.23 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 177.298 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -76.57 111.75 12.39 Favored 'General case' 0 CA--C 1.483 -1.598 0 N-CA-C 106.096 -1.816 . . . . 0.0 106.096 173.254 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 2.5 p -65.27 -19.72 66.09 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 113.065 0.765 . . . . 0.0 113.065 -175.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 42.1 p90 -97.69 -0.47 45.46 Favored 'General case' 0 C--N 1.286 -2.195 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.446 178.463 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.432 ' OD1' ' HG2' ' A' ' 54' ' ' GLN . 20.4 t0 -141.63 91.9 2.41 Favored 'General case' 0 CA--C 1.491 -1.318 0 C-N-CA 118.738 -1.185 . . . . 0.0 111.208 -176.593 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.562 ' HG3' ' HA2' ' A' ' 46' ' ' GLY . 0.1 OUTLIER -121.77 18.86 11.07 Favored 'General case' 0 C--N 1.291 -1.939 0 CA-C-O 121.639 0.733 . . . . 0.0 110.541 175.836 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -78.91 -33.36 45.59 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 176.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.484 ' HB3' HG11 ' A' ' 60' ' ' VAL . 10.3 mm100 -81.76 -3.85 54.86 Favored 'General case' 0 N--CA 1.42 -1.973 0 CA-C-N 113.854 -1.521 . . . . 0.0 110.863 -177.139 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . 0.57 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 46.6 ttm -62.63 114.83 3.8 Favored 'General case' 0 N--CA 1.421 -1.918 0 C-N-CA 123.115 0.566 . . . . 0.0 111.149 -177.785 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.01 5.66 89.47 Favored Glycine 0 N--CA 1.434 -1.481 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.994 179.301 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -81.38 141.18 34.22 Favored 'General case' 0 CA--C 1.496 -1.122 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 -177.386 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.554 ' O ' ' HD2' ' A' ' 61' ' ' TYR . 11.9 pt20 -78.72 -20.34 50.28 Favored 'General case' 0 C--N 1.277 -2.567 0 CA-C-N 114.926 -1.033 . . . . 0.0 109.332 177.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -58.18 -29.97 66.06 Favored 'General case' 0 CA--C 1.497 -1.082 0 CA-C-O 121.939 0.876 . . . . 0.0 111.064 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.688 HG23 ' HB2' ' A' ' 44' ' ' TYR . 21.7 m -115.29 2.3 8.04 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.998 0 CA-C-N 114.744 -1.116 . . . . 0.0 112.253 -171.297 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.554 ' HD2' ' O ' ' A' ' 58' ' ' GLN . 1.8 p90 -54.51 116.68 11.36 Favored Pre-proline 0 C--N 1.306 -1.307 0 O-C-N 124.373 1.045 . . . . 0.0 111.594 -175.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 61' ' ' TYR . 9.0 Cg_endo -87.92 109.17 0.63 Allowed 'Trans proline' 0 N--CA 1.426 -2.469 0 C-N-CA 122.763 2.309 . . . . 0.0 109.833 176.456 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -74.28 -141.19 0.65 Allowed Glycine 0 C--N 1.283 -2.38 0 CA-C-N 114.662 -1.154 . . . . 0.0 113.023 177.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.64 129.16 33.57 Favored 'Trans proline' 0 C--O 1.24 0.584 0 C-N-CA 123.04 2.493 . . . . 0.0 113.346 -176.592 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.584 HD11 ' HB3' ' A' ' 100' ' ' LEU . 47.6 mt -65.55 114.17 2.71 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.067 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.469 -178.719 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -108.36 127.53 53.96 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-O 120.775 0.321 . . . . 0.0 110.502 178.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.534 HD21 ' HA ' ' A' ' 33' ' ' VAL . 15.2 m120 -113.09 6.37 17.56 Favored 'General case' 0 C--N 1.302 -1.487 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.396 -176.693 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 12.1 t -53.8 -32.99 54.63 Favored 'General case' 0 CA--C 1.557 1.233 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 -174.355 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -73.96 -14.79 79.99 Favored Glycine 0 CA--C 1.525 0.691 0 C-N-CA 121.202 -0.523 . . . . 0.0 112.703 -179.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.516 HD12 HD22 ' A' ' 67' ' ' ASN . 61.6 mt -89.67 -15.56 32.37 Favored 'General case' 0 C--O 1.243 0.755 0 CA-C-O 121.949 0.881 . . . . 0.0 109.273 -179.451 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.633 ' HA ' ' HA ' ' A' ' 79' ' ' LEU . 74.9 mt -86.45 161.44 18.63 Favored 'General case' 0 C--N 1.292 -1.929 0 CA-C-N 114.863 -1.062 . . . . 0.0 112.065 -173.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt -92.12 -172.65 3.2 Favored 'General case' 0 C--N 1.308 -1.199 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 178.443 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -94.2 106.83 18.8 Favored 'General case' 0 C--N 1.291 -1.97 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 175.213 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 165.46 -96.12 0.13 Allowed Glycine 0 N--CA 1.433 -1.531 0 N-CA-C 111.383 -0.687 . . . . 0.0 111.383 -177.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -112.04 168.23 9.77 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 179.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.491 ' HA ' HD13 ' A' ' 71' ' ' LEU . . . -86.99 5.64 36.32 Favored 'General case' 0 C--N 1.305 -1.367 0 CA-C-O 122.135 0.969 . . . . 0.0 110.969 -176.824 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 -114.82 -1.95 13.07 Favored 'General case' 0 C--N 1.286 -2.18 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 178.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.8 m -93.87 107.01 18.95 Favored 'General case' 0 C--N 1.296 -1.76 0 CA-C-N 114.247 -1.342 . . . . 0.0 108.541 -177.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.633 ' HA ' ' HA ' ' A' ' 71' ' ' LEU . 1.5 pp -107.91 154.76 21.13 Favored 'General case' 0 C--N 1.292 -1.925 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.433 -174.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.473 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 50.3 mtmt -66.27 112.38 3.95 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 122.052 0.929 . . . . 0.0 111.007 179.194 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -60.12 -27.85 67.38 Favored 'General case' 0 C--N 1.298 -1.656 0 C-N-CA 124.979 1.312 . . . . 0.0 112.781 -173.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 33.0 m170 -91.96 11.58 24.62 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 112.43 0.53 . . . . 0.0 112.43 -175.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 80' ' ' LYS . 61.5 mt -77.36 133.95 38.59 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-O 121.007 0.432 . . . . 0.0 111.266 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 42.8 mt -81.0 164.15 3.11 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.179 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 177.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.742 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 5.3 p-10 -64.39 -110.87 0.0 OUTLIER 'General case' 0 C--O 1.19 -2.079 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -176.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -44.11 -29.67 0.65 Allowed 'General case' 0 CA--C 1.557 1.232 0 C-N-CA 127.946 2.498 . . . . 0.0 113.466 -177.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 22.9 mt -72.57 -57.59 4.03 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.283 -178.721 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -86.55 -29.45 22.65 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.637 -176.044 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . 0.742 ' CE1' ' HA ' ' A' ' 85' ' ' ASP . 7.8 p90 -155.94 -163.06 1.41 Allowed 'General case' 0 C--O 1.194 -1.853 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 -175.386 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.547 ' HB ' ' CG1' ' A' ' 33' ' ' VAL . 0.6 OUTLIER -136.74 148.48 26.79 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.085 0 N-CA-C 106.673 -1.603 . . . . 0.0 106.673 167.138 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.55 HD21 ' CD1' ' A' ' 32' ' ' LEU . 15.9 mt -107.33 123.49 48.42 Favored 'General case' 1 N--CA 1.367 -4.612 0 O-C-N 124.55 1.156 . . . . 0.0 109.24 169.688 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.464 HD13 HD23 ' A' ' 100' ' ' LEU . 12.0 mt -118.12 146.87 40.25 Favored Pre-proline 0 C--N 1.283 -2.318 0 N-CA-C 106.315 -1.735 . . . . 0.0 106.315 -178.098 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -71.17 169.56 20.34 Favored 'Trans proline' 0 C--O 1.259 1.574 0 C-N-CA 121.974 1.783 . . . . 0.0 108.109 176.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.593 ' O ' ' HB2' ' A' ' 98' ' ' ASN . 98.6 m -38.96 -52.2 1.79 Allowed 'General case' 0 CA--C 1.543 0.675 0 O-C-N 123.991 0.807 . . . . 0.0 111.707 178.082 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -72.66 -30.95 64.71 Favored 'General case' 0 CA--C 1.498 -1.021 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 -175.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.614 ' O ' HD22 ' A' ' 100' ' ' LEU . . . -62.75 -55.05 29.21 Favored Glycine 0 N--CA 1.43 -1.722 0 N-CA-C 109.158 -1.577 . . . . 0.0 109.158 178.102 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.446 ' HB2' ' HB2' ' A' ' 31' ' ' TYR . 68.5 t-105 -58.79 -49.82 76.25 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 123.752 0.821 . . . . 0.0 110.047 178.777 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.593 ' HB2' ' O ' ' A' ' 94' ' ' THR . 5.9 t-20 -48.52 -44.33 36.05 Favored 'General case' 0 C--O 1.207 -1.174 0 C-N-CA 124.909 1.283 . . . . 0.0 110.11 179.096 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -66.84 -51.82 51.03 Favored 'General case' 0 N--CA 1.423 -1.797 0 CA-C-O 119.16 -0.447 . . . . 0.0 111.458 178.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.614 HD22 ' O ' ' A' ' 96' ' ' GLY . 0.4 OUTLIER -59.47 -34.51 72.64 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 121.396 0.617 . . . . 0.0 112.071 179.929 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.507 ' HA ' ' HA ' ' A' ' 105' ' ' THR . 24.0 t -78.0 -27.34 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.378 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.969 178.183 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 73.8 m -78.87 -32.08 45.79 Favored 'General case' 0 C--N 1.291 -1.969 0 O-C-N 121.08 -1.013 . . . . 0.0 109.022 176.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' TRP . . . . . 0.471 ' CD1' ' HB1' ' A' ' 6' ' ' ALA . 50.6 m0 -79.88 -49.78 11.43 Favored 'General case' 0 N--CA 1.423 -1.792 0 CA-C-N 115.428 -0.805 . . . . 0.0 112.316 -177.772 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -129.92 5.06 4.96 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -175.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.507 ' HA ' ' HA ' ' A' ' 101' ' ' VAL 0.321 13.6 t 49.63 -176.5 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 123.876 1.798 . . . . 0.0 115.268 -176.926 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.426 HD13 ' CH2' ' A' ' 97' ' ' TRP . 37.0 tp -104.56 156.33 18.05 Favored 'General case' 1 C--N 1.23 -4.623 0 CA-C-N 112.022 -2.354 . . . . 0.0 107.251 -175.982 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 32.6 tpp -69.38 132.58 46.6 Favored 'General case' 1 N--CA 1.366 -4.633 0 CA-C-O 122.353 1.073 . . . . 0.0 110.294 178.559 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -63.92 136.87 57.72 Favored 'General case' 0 C--N 1.251 -3.677 0 CA-C-N 112.29 -2.232 . . . . 0.0 111.15 -176.093 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 93.64 -18.04 57.31 Favored Glycine 0 N--CA 1.416 -2.684 0 CA-C-N 114.99 -1.005 . . . . 0.0 112.533 179.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -113.88 127.33 55.94 Favored 'General case' 1 N--CA 1.362 -4.866 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 -179.581 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 -98.36 153.32 38.08 Favored Pre-proline 0 C--N 1.301 -1.536 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 -179.518 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_exo -48.49 129.36 19.66 Favored 'Trans proline' 0 CA--C 1.485 -1.953 0 C-N-CA 124.397 3.398 . . . . 0.0 115.985 -174.395 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.44 ' N ' HD12 ' A' ' 113' ' ' ILE . 3.1 mp -92.4 108.95 20.83 Favored 'Isoleucine or valine' 0 N--CA 1.384 -3.732 0 CA-C-N 111.796 -2.456 . . . . 0.0 105.764 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.406 ' HB1' ' CG2' ' A' ' 29' ' ' THR . . . -118.6 149.89 40.6 Favored 'General case' 0 C--N 1.292 -1.901 0 N-CA-C 114.02 1.119 . . . . 0.0 114.02 -173.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 81.8 mtt180 -135.61 167.1 21.74 Favored 'General case' 0 CA--C 1.47 -2.113 0 C-N-CA 125.873 1.669 . . . . 0.0 107.121 172.181 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -101.33 176.02 5.38 Favored 'General case' 0 C--N 1.262 -3.234 0 C-N-CA 118.536 -1.266 . . . . 0.0 110.902 179.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.626 HG11 ' O ' ' A' ' 25' ' ' ARG . 48.3 t -47.99 134.73 4.91 Favored 'Isoleucine or valine' 0 C--O 1.241 0.625 0 CA-C-O 122.687 1.232 . . . . 0.0 112.495 -176.166 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 2.7 m -104.87 178.79 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.268 -2.949 0 CA-C-N 112.511 -2.131 . . . . 0.0 109.472 -175.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -91.28 -28.02 18.05 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -175.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 . . . . . 0 N--CA 1.478 0.968 0 C-N-CA 124.743 1.217 . . . . 0.0 113.721 -174.236 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.6 mtt . . . . . 0 CA--C 1.507 -0.678 0 N-CA-C 109.635 -0.505 . . . . 0.0 109.635 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -83.08 135.84 34.69 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.449 -178.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -122.15 169.32 11.0 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.778 -178.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 92.55 -34.35 4.53 Favored Glycine 0 C--N 1.31 -0.877 0 C-N-CA 121.513 -0.375 . . . . 0.0 113.475 176.103 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 83.37 -91.92 1.63 Allowed Glycine 0 N--CA 1.436 -1.338 0 N-CA-C 109.986 -1.246 . . . . 0.0 109.986 -177.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -136.05 169.22 17.95 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 177.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.488 ' HB1' ' CG2' ' A' ' 11' ' ' THR . . . -87.06 163.06 17.24 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-O 121.371 0.605 . . . . 0.0 111.34 -179.006 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.652 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 13.3 t70 -64.19 143.06 58.17 Favored 'General case' 0 CA--C 1.48 -1.724 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.072 171.353 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -40.3 -56.83 1.88 Allowed 'General case' 0 C--N 1.299 -1.595 0 C-N-CA 126.422 1.889 . . . . 0.0 112.407 176.569 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -73.66 -25.66 60.37 Favored 'General case' 0 C--N 1.27 -2.879 0 CA-C-N 114.682 -1.144 . . . . 0.0 110.771 -174.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.526 ' HB ' ' O ' ' A' ' 8' ' ' ASP . 2.2 m -68.31 -44.98 74.19 Favored 'General case' 0 N--CA 1.398 -3.064 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 175.553 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.652 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 75.1 mt-30 -55.41 -61.62 2.22 Favored 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 123.761 0.825 . . . . 0.0 112.484 -175.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.477 ' HB3' HG13 ' A' ' 45' ' ' VAL . 1.4 ptm180 -51.23 -41.56 60.4 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 121.373 0.606 . . . . 0.0 112.32 179.125 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.6 m -72.53 -44.25 62.43 Favored 'General case' 0 C--N 1.291 -1.954 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.792 -176.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -76.04 -19.6 58.49 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.144 -174.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.607 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 27.4 mm -87.71 -31.07 5.71 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.159 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.024 176.242 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.466 ' O ' ' HG3' ' A' ' 21' ' ' LYS . . . -59.36 -35.09 73.24 Favored 'General case' 0 CA--C 1.498 -1.029 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 -177.828 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 7.3 m -53.8 -53.32 54.04 Favored 'General case' 0 N--CA 1.415 -2.181 0 C-N-CA 126.506 1.922 . . . . 0.0 111.048 176.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.657 ' HB3' ' HD2' ' A' ' 93' ' ' PRO . 1.6 mm? -72.1 -15.23 62.0 Favored 'General case' 1 N--CA 1.356 -5.141 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 179.951 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.607 ' HG ' ' O ' ' A' ' 16' ' ' ILE . 11.9 mt -86.03 -24.1 26.53 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-O 121.929 0.871 . . . . 0.0 109.617 177.824 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.466 ' HG3' ' O ' ' A' ' 17' ' ' ALA . 0.1 OUTLIER -90.9 -4.12 56.79 Favored 'General case' 0 CA--C 1.5 -0.98 0 CA-C-O 122.33 1.062 . . . . 0.0 111.521 -174.25 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 32.0 m -90.07 141.44 28.67 Favored 'General case' 0 N--CA 1.389 -3.49 0 CA-C-N 113.557 -1.656 . . . . 0.0 111.048 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.1 m -108.62 166.26 10.93 Favored 'General case' 0 N--CA 1.399 -2.977 0 CA-C-N 113.734 -1.575 . . . . 0.0 110.743 178.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.512 HD13 ' H ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -108.06 167.03 10.28 Favored 'General case' 1 N--CA 1.36 -4.936 0 CA-C-N 113.121 -1.854 . . . . 0.0 114.111 -170.897 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.645 ' O ' HG21 ' A' ' 117' ' ' VAL . 0.0 OUTLIER -126.83 159.86 32.63 Favored 'General case' 0 C--N 1.261 -3.251 0 CA-C-N 111.423 -2.626 . . . . 0.0 104.873 -178.821 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -67.6 132.6 47.85 Favored 'General case' 0 C--N 1.289 -2.063 0 CA-C-N 117.939 0.336 . . . . 0.0 110.983 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 99.01 -2.7 58.21 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.864 -0.684 . . . . 0.0 113.559 176.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.564 ' OD2' ' HB2' ' A' ' 25' ' ' ARG . 8.3 m-20 -86.77 155.51 20.3 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 117.18 0.49 . . . . 0.0 112.179 -177.672 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.428 ' CG2' ' HB1' ' A' ' 114' ' ' ALA . 41.3 m -108.67 136.56 48.04 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.3 -178.692 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.475 ' CZ2' HD12 ' A' ' 24' ' ' LEU . 36.4 m95 -122.46 153.89 38.53 Favored 'General case' 0 N--CA 1.429 -1.515 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 176.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -106.56 129.35 54.52 Favored 'General case' 0 C--N 1.273 -2.729 0 CA-C-O 120.992 0.425 . . . . 0.0 110.246 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.665 HD11 ' CG ' ' A' ' 89' ' ' TYR . 27.1 tp -90.0 128.98 36.38 Favored 'General case' 1 N--CA 1.367 -4.625 0 CA-C-N 114.335 -1.302 . . . . 0.0 113.039 -177.229 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.403 HG12 ' O ' ' A' ' 34' ' ' ASP . 55.3 t -118.09 139.77 44.02 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.012 0 C-N-CA 126.111 1.765 . . . . 0.0 108.743 -178.646 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.587 ' OD2' ' HB2' ' A' ' 36' ' ' ARG . 10.9 t70 -64.73 123.53 19.58 Favored 'General case' 0 C--N 1.299 -1.615 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 169.812 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.4 t -65.6 -27.55 68.49 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 120.989 0.423 . . . . 0.0 109.883 -172.564 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.587 ' HB2' ' OD2' ' A' ' 34' ' ' ASP . 67.8 mtt85 -66.95 -34.95 78.9 Favored 'General case' 0 C--O 1.243 0.752 0 C-N-CA 123.459 0.704 . . . . 0.0 110.236 -177.608 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 69.7 t90 -71.34 -46.25 60.99 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 175.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 30.3 t80 -58.6 -41.44 85.83 Favored 'General case' 0 CA--C 1.549 0.937 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.979 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.575 ' O ' ' HG3' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -51.32 -48.87 62.23 Favored 'General case' 0 CA--C 1.489 -1.395 0 CA-C-N 118.231 0.468 . . . . 0.0 111.178 173.075 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.406 ' HG3' ' O ' ' A' ' 60' ' ' VAL . 22.4 tp60 -60.12 -43.92 95.29 Favored 'General case' 0 N--CA 1.409 -2.498 0 O-C-N 123.796 0.685 . . . . 0.0 110.634 -177.101 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 76.5 t90 -61.07 -39.99 91.97 Favored 'General case' 0 C--O 1.214 -0.77 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.451 178.526 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.508 ' HD3' ' HA ' ' A' ' 39' ' ' LYS . 14.4 mtpp -60.1 -41.0 91.57 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-O 120.927 0.394 . . . . 0.0 111.742 -178.494 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.575 ' HG3' ' O ' ' A' ' 39' ' ' LYS . 18.3 mtpp -73.57 -39.06 64.94 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 -175.316 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.688 ' HB2' HG23 ' A' ' 60' ' ' VAL . 0.2 OUTLIER -67.41 -44.34 79.03 Favored 'General case' 0 N--CA 1.428 -1.543 0 CA-C-N 114.173 -1.376 . . . . 0.0 111.205 -179.654 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.477 HG13 ' HB3' ' A' ' 13' ' ' ARG . 2.3 p -85.14 -12.34 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.608 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.323 -174.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 66.33 43.15 93.39 Favored Glycine 0 N--CA 1.44 -1.086 0 N-CA-C 109.879 -1.288 . . . . 0.0 109.879 -175.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.466 ' HB2' ' CG1' ' A' ' 45' ' ' VAL . 88.2 t80 -64.82 -40.51 95.32 Favored 'General case' 0 N--CA 1.437 -1.111 0 C-N-CA 123.802 0.841 . . . . 0.0 108.976 -179.039 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.462 ' O ' ' HB2' ' A' ' 52' ' ' LYS . 7.4 m-20 -95.64 132.74 40.48 Favored 'General case' 0 C--N 1.298 -1.639 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 179.253 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.2 m -69.11 -22.44 63.97 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-O 121.488 0.661 . . . . 0.0 111.982 -179.465 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 38.7 p90 -99.3 2.3 45.34 Favored 'General case' 0 C--N 1.302 -1.489 0 C-N-CA 123.512 0.725 . . . . 0.0 110.379 -177.651 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.499 ' OD2' ' HG2' ' A' ' 43' ' ' LYS . 14.9 t70 -150.18 73.15 1.14 Allowed 'General case' 0 CA--C 1.472 -2.03 0 N-CA-C 103.608 -2.738 . . . . 0.0 103.608 -176.634 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 48' ' ' ASP 0.386 53.4 tptt -142.57 13.89 1.95 Allowed 'General case' 0 N--CA 1.393 -3.3 0 CA-C-N 110.661 -2.972 . . . . 0.0 109.237 -157.733 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 59.7 m-85 -99.36 -13.28 19.67 Favored 'General case' 0 C--N 1.293 -1.88 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.435 -173.332 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.545 ' HB3' HG11 ' A' ' 60' ' ' VAL . 43.0 mt-30 -97.94 6.98 47.08 Favored 'General case' 0 N--CA 1.426 -1.644 0 N-CA-C 107.961 -1.125 . . . . 0.0 107.961 176.605 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . 0.526 ' HA ' ' O ' ' A' ' 44' ' ' TYR . 56.7 ttp -63.63 116.02 5.27 Favored 'General case' 0 N--CA 1.412 -2.352 0 CA-C-N 114.795 -1.093 . . . . 0.0 109.848 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.73 18.26 75.73 Favored Glycine 0 N--CA 1.429 -1.796 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.612 -179.192 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.59 ' HB3' HG22 ' A' ' 60' ' ' VAL . 9.3 t0 -94.34 143.95 25.96 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 179.313 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.451 ' O ' ' HD2' ' A' ' 61' ' ' TYR . 13.7 pt20 -84.3 -15.79 45.37 Favored 'General case' 0 C--N 1.291 -1.95 0 CA-C-O 122.007 0.908 . . . . 0.0 110.647 -179.198 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 -64.71 -28.06 69.34 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-N 114.659 -1.155 . . . . 0.0 111.217 177.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.688 HG23 ' HB2' ' A' ' 44' ' ' TYR . 33.2 m -115.65 1.82 8.12 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.099 0 CA-C-N 114.952 -1.022 . . . . 0.0 112.089 -172.038 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.451 ' HD2' ' O ' ' A' ' 58' ' ' GLN . 0.8 OUTLIER -64.87 118.13 45.68 Favored Pre-proline 0 C--N 1.307 -1.266 0 C-N-CA 119.638 -0.825 . . . . 0.0 109.696 -178.988 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 61' ' ' TYR . 18.4 Cg_endo -87.46 113.8 0.95 Allowed 'Trans proline' 0 N--CA 1.412 -3.282 0 C-N-CA 122.429 2.086 . . . . 0.0 109.828 177.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -73.26 -134.35 0.23 Allowed Glycine 0 C--N 1.275 -2.816 0 CA-C-N 114.233 -1.348 . . . . 0.0 112.105 177.115 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -56.65 131.06 43.31 Favored 'Trans proline' 0 CA--C 1.502 -1.108 0 C-N-CA 122.518 2.146 . . . . 0.0 112.357 -177.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.528 ' O ' HD23 ' A' ' 106' ' ' LEU . 96.2 mt -58.56 112.44 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.551 0 CA-C-N 114.365 -1.288 . . . . 0.0 109.505 177.185 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -106.86 103.45 12.89 Favored 'General case' 0 C--N 1.288 -2.095 0 N-CA-C 107.073 -1.455 . . . . 0.0 107.073 178.11 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.535 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 90.3 m-20 -90.74 6.22 45.0 Favored 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.818 173.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.8 m -54.13 -29.95 47.06 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.583 1.153 . . . . 0.0 111.971 -177.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -64.94 -25.16 70.58 Favored Glycine 0 CA--C 1.523 0.589 0 C-N-CA 121.59 -0.338 . . . . 0.0 112.295 178.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 72.8 mt -92.22 -23.03 19.48 Favored 'General case' 0 CA--C 1.496 -1.097 0 CA-C-O 120.816 0.341 . . . . 0.0 110.198 179.099 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 67' ' ' ASN . 21.5 mt -78.94 152.18 31.24 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.788 -172.418 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 72.9 mttt -60.02 168.18 1.98 Allowed 'General case' 0 N--CA 1.422 -1.875 0 CA-C-O 122.981 1.372 . . . . 0.0 114.589 177.013 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -89.09 83.43 6.54 Favored 'General case' 0 C--N 1.282 -2.343 0 CA-C-N 113.051 -1.886 . . . . 0.0 108.716 -178.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 137.38 -59.3 0.63 Allowed Glycine 0 N--CA 1.431 -1.665 0 CA-C-N 114.649 -1.16 . . . . 0.0 110.909 -178.292 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -92.32 123.51 35.71 Favored 'General case' 0 CA--C 1.508 -0.664 0 CA-C-O 120.896 0.379 . . . . 0.0 110.907 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -92.95 14.43 17.64 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 121.813 0.816 . . . . 0.0 110.1 179.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 15.2 mm-40 -119.69 7.24 11.02 Favored 'General case' 0 C--N 1.28 -2.431 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 -178.258 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 50.0 m -132.7 134.27 44.57 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 114.197 -1.365 . . . . 0.0 111.917 -173.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.9 mt -78.64 157.74 28.59 Favored 'General case' 0 C--N 1.315 -0.93 0 O-C-N 123.499 0.499 . . . . 0.0 109.731 175.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -72.89 158.47 35.44 Favored 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 173.054 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -90.06 -3.92 57.67 Favored 'General case' 0 C--N 1.293 -1.862 0 CA-C-O 121.075 0.464 . . . . 0.0 111.249 -178.47 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -99.25 11.37 39.25 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -177.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 32.6 mt -84.24 166.82 17.2 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-O 121.854 0.835 . . . . 0.0 113.162 -170.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.627 HG21 HD12 ' A' ' 87' ' ' LEU . 53.8 mt -142.23 173.61 7.21 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 N-CA-C 105.14 -2.17 . . . . 0.0 105.14 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.643 ' HA ' ' CE1' ' A' ' 89' ' ' TYR . 25.8 t70 -67.95 -142.03 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.95 0 CA-C-O 117.37 -1.3 . . . . 0.0 110.438 -179.524 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.509 ' HA ' ' O ' ' A' ' 89' ' ' TYR . 9.5 pt-20 -40.53 -18.62 0.01 OUTLIER 'General case' 0 N--CA 1.509 2.503 0 N-CA-C 117.625 2.454 . . . . 0.0 117.625 -173.09 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.627 HD12 HG21 ' A' ' 84' ' ' ILE . 21.0 mt -62.24 -51.57 67.23 Favored 'General case' 0 C--N 1.285 -2.232 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 171.049 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -102.12 -45.82 5.03 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.903 -177.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . 0.665 ' CG ' HD11 ' A' ' 32' ' ' LEU . 0.9 OUTLIER -140.3 167.89 21.08 Favored 'General case' 0 C--O 1.164 -3.416 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.669 -174.096 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.495 ' O ' HD12 ' A' ' 32' ' ' LEU . 4.3 mt -136.16 146.69 28.77 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.511 0 O-C-N 120.851 -1.156 . . . . 0.0 110.665 178.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.461 HD23 ' HA ' ' A' ' 91' ' ' LEU . 64.5 mt -109.04 133.72 52.61 Favored 'General case' 0 C--N 1.291 -1.958 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.761 178.651 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.46 HD12 ' N ' ' A' ' 92' ' ' LEU . 1.0 OUTLIER -140.78 156.13 68.97 Favored Pre-proline 0 C--N 1.289 -2.038 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 -178.54 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.657 ' HD2' ' HB3' ' A' ' 19' ' ' LEU . 39.6 Cg_exo -64.58 168.9 12.19 Favored 'Trans proline' 0 C--O 1.252 1.215 0 C-N-CA 122.975 2.45 . . . . 0.0 111.225 175.789 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.469 HG22 ' ND2' ' A' ' 98' ' ' ASN . 86.9 m -45.62 -47.76 14.73 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 124.421 1.088 . . . . 0.0 109.766 172.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.538 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.1 mp0 -51.8 -54.41 29.07 Favored 'General case' 0 C--O 1.209 -1.027 0 C-N-CA 125.421 1.488 . . . . 0.0 110.689 178.386 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.561 ' O ' HD22 ' A' ' 100' ' ' LEU . . . -54.98 -60.97 7.89 Favored Glycine 0 N--CA 1.43 -1.748 0 O-C-N 124.388 1.055 . . . . 0.0 111.273 -177.533 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.46 ' HZ2' HD11 ' A' ' 106' ' ' LEU . 68.5 t-105 -52.13 -50.22 62.13 Favored 'General case' 0 C--N 1.308 -1.238 0 C-N-CA 124.361 1.064 . . . . 0.0 111.184 178.385 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.469 ' ND2' HG22 ' A' ' 94' ' ' THR . 89.6 m-20 -53.47 -37.21 62.45 Favored 'General case' 0 C--O 1.187 -2.208 0 CA-C-O 118.791 -0.623 . . . . 0.0 111.585 177.74 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.464 ' HG3' ' O ' ' A' ' 95' ' ' GLU . 87.6 mttt -69.56 -50.36 45.57 Favored 'General case' 0 N--CA 1.41 -2.449 0 CA-C-N 118.6 0.636 . . . . 0.0 109.827 -178.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.561 HD22 ' O ' ' A' ' 96' ' ' GLY . 0.8 OUTLIER -58.75 -38.49 78.55 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.295 0.569 . . . . 0.0 111.731 178.588 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.414 ' O ' ' HA ' ' A' ' 105' ' ' THR . 37.9 t -74.35 -31.16 27.8 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.931 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.428 178.816 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 57.9 m -72.17 -36.16 69.2 Favored 'General case' 0 N--CA 1.418 -2.071 0 CA-C-O 121.717 0.77 . . . . 0.0 109.512 -179.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' TRP . . . . . 0.407 ' CZ2' ' HB3' ' A' ' 99' ' ' LYS . 38.4 m0 -78.57 -51.33 10.08 Favored 'General case' 0 N--CA 1.424 -1.738 0 CA-C-N 114.692 -1.14 . . . . 0.0 111.998 -176.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -123.2 4.39 9.21 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 114.558 1.318 . . . . 0.0 114.558 -172.427 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.414 ' HA ' ' O ' ' A' ' 101' ' ' VAL 0.271 22.8 p 54.29 174.87 0.02 OUTLIER 'General case' 0 N--CA 1.413 -2.301 0 N-CA-C 116.089 1.885 . . . . 0.0 116.089 -177.856 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.674 ' CD1' ' HD3' ' A' ' 112' ' ' PRO . 0.5 OUTLIER -98.86 179.88 4.5 Favored 'General case' 0 N--CA 1.407 -2.621 0 CA-C-N 114.961 -1.018 . . . . 0.0 108.308 -179.974 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.619 ' H ' HD23 ' A' ' 106' ' ' LEU . 19.5 ttm -94.95 134.58 37.46 Favored 'General case' 1 N--CA 1.347 -5.621 0 CA-C-O 122.027 0.918 . . . . 0.0 109.846 178.08 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -64.32 123.63 19.65 Favored 'General case' 0 N--CA 1.393 -3.319 0 CA-C-N 113.316 -1.766 . . . . 0.0 111.267 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 112.33 -19.01 22.73 Favored Glycine 0 N--CA 1.405 -3.371 0 C-N-CA 119.911 -1.138 . . . . 0.0 111.626 178.463 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.492 ' HG2' ' O ' ' A' ' 107' ' ' MET . 2.6 pt20 -116.6 164.52 14.48 Favored 'General case' 0 N--CA 1.406 -2.628 0 C-N-CA 119.966 -0.694 . . . . 0.0 109.64 178.435 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -135.94 144.9 50.37 Favored Pre-proline 0 C--N 1.29 -1.985 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.15 -179.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . 0.674 ' HD3' ' CD1' ' A' ' 106' ' ' LEU . 36.3 Cg_exo -42.7 132.63 5.47 Favored 'Trans proline' 0 CA--C 1.457 -3.327 0 C-N-CA 125.216 3.944 . . . . 0.0 113.427 177.305 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.523 HD11 HD21 ' A' ' 71' ' ' LEU . 3.2 mp -93.11 106.53 18.05 Favored 'Isoleucine or valine' 1 N--CA 1.368 -4.541 0 CA-C-N 113.302 -1.772 . . . . 0.0 106.527 177.73 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.428 ' HB1' ' CG2' ' A' ' 29' ' ' THR . . . -91.08 127.7 36.61 Favored 'General case' 0 N--CA 1.406 -2.649 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 177.53 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 15.2 tpt180 -121.63 129.79 53.05 Favored 'General case' 0 C--N 1.271 -2.817 0 N-CA-C 105.732 -1.951 . . . . 0.0 105.732 -177.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? -82.28 168.34 17.7 Favored 'General case' 0 C--N 1.272 -2.793 0 C-N-CA 119.687 -0.805 . . . . 0.0 109.014 176.476 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.645 HG21 ' O ' ' A' ' 25' ' ' ARG . 65.4 t -51.51 141.5 4.87 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-O 122.03 0.919 . . . . 0.0 111.157 -178.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 17.2 m -79.6 178.13 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.403 -2.814 0 CA-C-N 113.987 -1.46 . . . . 0.0 114.389 -169.011 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -89.11 -1.2 57.99 Favored 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 114.059 -1.428 . . . . 0.0 111.408 -176.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 . . . . . 0 C--N 1.307 -1.28 0 CA-C-O 119.096 -0.478 . . . . 0.0 109.761 -177.95 . . . . . . . . 0 0 . 1 stop_ save_